N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide

C129H250N18O10 — CID 158415291

About N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide

N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide (PubChem CID 158415291) has the molecular formula C129H250N18O10 and a molecular weight of 2213.53 g/mol. Its IUPAC name is N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide.

Molecular Properties

• Compound Name: N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide
• PubChem CID: 158415291
• Molecular Formula: C129H250N18O10
• Molecular Weight: 2213.53 g/mol
• Exact Mass: 2211.96
• IUPAC Name: N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide
• SMILES: CC(C)CC(C)(C)C(=O)N1CCC(CN)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CC1)CNC2.CC(C)CC(C)(C)C(=O)N1CCC2(CC1)CNCCO2.CC(C)CC(C)(C)C(=O)N1CCC2(CCCNC2)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CCNC2)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CCNCC2)C1.CC(C)CC(C)(C)C(=O)N1CCCC1CN.CC(C)CC(C)(C)C(=O)NC1CCNC1.CC(C)CC(C)(C)C(=O)NCCN
• InChI: InChI=1S/C17H32N2O.C16H30N2O2.2C16H30N2O.C15H28N2O.C14H28N2O.C13H26N2O.C12H24N2O.C10H22N2O/c1-14(2)12-16(3,4)15(20)19-10-7-17(8-11-19)6-5-9-18-13-17;1-13(2)11-15(3,4)14(19)18-8-5-16(6-9-18)12-17-7-10-20-16;1-13(2)11-15(3,4)14(19)18-9-6-16(7-10-18)5-8-17-12-16;1-13(2)11-15(3,4)14(19)18-10-7-16(12-18)5-8-17-9-6-16;1-12(2)9-14(3,4)13(18)17-7-5-15(6-8-17)10-16-11-15;1-11(2)9-14(3,4)13(17)16-7-5-12(10-15)6-8-16;1-10(2)8-13(3,4)12(16)15-7-5-6-11(15)9-14;1-9(2)7-12(3,4)11(15)14-10-5-6-13-8-10;1-8(2)7-10(3,4)9(13)12-6-5-11/h14,18H,5-13H2,1-4H3;13,17H,5-12H2,1-4H3;2*13,17H,5-12H2,1-4H3;12,16H,5-11H2,1-4H3;11-12H,5-10,15H2,1-4H3;10-11H,5-9,14H2,1-4H3;9-10,13H,5-8H2,1-4H3,(H,14,15);8H,5-7,11H2,1-4H3,(H,12,13)
• InChIKey: GZUYWKPAXRCMPI-UHFFFAOYSA-N
• XLogP: 19.62
• TPSA: 359.84 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 19
• Rotatable Bonds: 32
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2213.53
LogP ≤ 5	19.62
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide?

The IUPAC name of N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide (CID 158415291) is N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide.

What is the SMILES notation for N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide?

The canonical SMILES for N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide is CC(C)CC(C)(C)C(=O)N1CCC(CN)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CC1)CNC2.CC(C)CC(C)(C)C(=O)N1CCC2(CC1)CNCCO2.CC(C)CC(C)(C)C(=O)N1CCC2(CCCNC2)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CCNC2)CC1.CC(C)CC(C)(C)C(=O)N1CCC2(CCNCC2)C1.CC(C)CC(C)(C)C(=O)N1CCCC1CN.CC(C)CC(C)(C)C(=O)NC1CCNC1.CC(C)CC(C)(C)C(=O)NCCN.

What is the InChIKey of N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide?

The InChIKey is GZUYWKPAXRCMPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O.C16H30N2O2.2C16H30N2O.C15H28N2O.C14H28N2O.C13H26N2O.C12H24N2O.C10H22N2O/c1-14(2)12-16(3,4)15(20)19-10-7-17(8-11-19)6-5-9-18-13-17;1-13(2)11-15(3,4)14(19)18-8-5-16(6-9-18)12-17-7-10-20-16;1-13(2)11-15(3,4)14(19)18-9-6-16(7-10-18)5-8-17-12-16;1-13(2)11-15(3,4)14(19)18-10-7-16(12-18)5-8-17-9-6-16;1-12(2)9-14(3,4)13(18)17-7-5-15(6-8-17)10-16-11-15;1-11(2)9-14(3,4)13(17)16-7-5-12(10-15)6-8-16;1-10(2)8-13(3,4)12(16)15-7-5-6-11(15)9-14;1-9(2)7-12(3,4)11(15)14-10-5-6-13-8-10;1-8(2)7-10(3,4)9(13)12-6-5-11/h14,18H,5-13H2,1-4H3;13,17H,5-12H2,1-4H3;2*13,17H,5-12H2,1-4H3;12,16H,5-11H2,1-4H3;11-12H,5-10,15H2,1-4H3;10-11H,5-9,14H2,1-4H3;9-10,13H,5-8H2,1-4H3,(H,14,15);8H,5-7,11H2,1-4H3,(H,12,13).

What are the key properties of N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide?

N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide has a molecular weight of 2213.53 g/mol, XLogP of 19.62, 32 rotatable bonds, 11 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminoethyl)-2,2,4-trimethylpentanamide;1-[4-(aminomethyl)piperidin-1-yl]-2,2,4-trimethylpentan-1-one;1-[2-(aminomethyl)pyrrolidin-1-yl]-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-2-yl)-2,2,4-trimethylpentan-1-one;1-(2,8-diazaspiro[4.5]decan-8-yl)-2,2,4-trimethylpentan-1-one;1-(2,7-diazaspiro[3.5]nonan-7-yl)-2,2,4-trimethylpentan-1-one;1-(2,9-diazaspiro[5.5]undecan-9-yl)-2,2,4-trimethylpentan-1-one;2,2,4-trimethyl-1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)pentan-1-one;2,2,4-trimethyl-N-pyrrolidin-3-ylpentanamide is sourced from PubChem (CID 158415291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).