4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide

C15H29N3O2 — CID 64669409

IUPAC4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide
SMILESCC(C)C(CCN)CCC(=O)NC1CCC(=O)N(C)C1
InChIInChI=1S/C15H29N3O2/c1-11(2)12(8-9-16)4-6-14(19)17-13-5-7-15(20)18(3)10-13/h11-13H,4-10,16H2,1-3H3,(H,17,19)
InChIKeyWASJWOGXKWHWLZ-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.12
Rot. Bonds7

About 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide

4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide (PubChem CID 64669409) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide.

Molecular Properties

Compound Name4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide
PubChem CID64669409
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide
SMILESCC(C)C(CCN)CCC(=O)NC1CCC(=O)N(C)C1
InChIInChI=1S/C15H29N3O2/c1-11(2)12(8-9-16)4-6-14(19)17-13-5-7-15(20)18(3)10-13/h11-13H,4-10,16H2,1-3H3,(H,17,19)
InChIKeyWASJWOGXKWHWLZ-UHFFFAOYSA-N
XLogP1.12
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1-methyl-6-oxopiperidin-3-yl)amino]-4-oxobutanoic acid
CID 64655943
3-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)propanamide
CID 64667203
5-amino-2-methyl-N-(1-methyl-6-oxopiperidin-3-yl)pentanamide
CID 104685189
3-ethoxy-N-[(3S)-1-methyl-6-oxopiperidin-3-yl]propanamide
CID 124575480
2-[4-(aminomethyl)phenyl]-N-(1-methyl-6-oxopiperidin-3-yl)acetamide
CID 64656494
3-(4-aminophenyl)-N-(1-methyl-6-oxopiperidin-3-yl)propanamide
CID 64655886
3-(ethylamino)-N-(1-methyl-6-oxopiperidin-3-yl)butanamide
CID 64668234
4-(2-aminoethyl)-5-methyl-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 114155694
4-(2-aminoethyl)-N-(2,3-dihydro-1H-inden-2-yl)-5-methylhexanamide
CID 107842822
tert-butyl 4-[(1-methyl-6-oxopiperidin-3-yl)amino]-4-oxobutanoate
CID 106707504
2-methyl-3-[(1-methyl-6-oxopiperidin-3-yl)carbamoylamino]propanoic acid
CID 64669836
2-(aminomethyl)-4,4-dimethyl-N-(1-methyl-6-oxopiperidin-3-yl)pentanamide
CID 107472255

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide?
The IUPAC name of 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide (CID 64669409) is 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide.
What is the SMILES notation for 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide?
The canonical SMILES for 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide is CC(C)C(CCN)CCC(=O)NC1CCC(=O)N(C)C1.
What is the InChIKey of 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide?
The InChIKey is WASJWOGXKWHWLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-11(2)12(8-9-16)4-6-14(19)17-13-5-7-15(20)18(3)10-13/h11-13H,4-10,16H2,1-3H3,(H,17,19).
What are the key properties of 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide?
4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide has a molecular weight of 283.42 g/mol, XLogP of 1.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-5-methyl-N-(1-methyl-6-oxopiperidin-3-yl)hexanamide is sourced from PubChem (CID 64669409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).