N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine

C15H33N3 — CID 79409671

IUPACN,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine
SMILESCC(C)NCC(C)C(C)N1CCC(N(C)C)CC1
InChIInChI=1S/C15H33N3/c1-12(2)16-11-13(3)14(4)18-9-7-15(8-10-18)17(5)6/h12-16H,7-11H2,1-6H3
InChIKeyJCYDUSVGOQGBAR-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.04
Rot. Bonds6

About N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine

N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine (PubChem CID 79409671) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine
PubChem CID79409671
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine
SMILESCC(C)NCC(C)C(C)N1CCC(N(C)C)CC1
InChIInChI=1S/C15H33N3/c1-12(2)16-11-13(3)14(4)18-9-7-15(8-10-18)17(5)6/h12-16H,7-11H2,1-6H3
InChIKeyJCYDUSVGOQGBAR-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[1-(propan-2-ylamino)propan-2-yl]piperidin-4-amine
CID 62433161
3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79409918
2-methyl-N-propan-2-yl-3-(2-propan-2-ylpyrrolidin-1-yl)butan-1-amine
CID 79408560
1-(4-amino-3-methylbutan-2-yl)-N,N-dimethylpyrrolidin-3-amine
CID 79408643
3-(3,3-dimethylpiperidin-1-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79408655
1-butan-2-yl-N,N-dimethylpiperidin-4-amine
CID 90697678
N,N-dimethyl-1-[5-(propan-2-ylamino)pentan-2-yl]pyrrolidin-3-amine
CID 55158377
N-propan-2-yl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103503231
3-N-cycloheptyl-3-N,2-dimethyl-1-N-propan-2-ylbutane-1,3-diamine
CID 79409031
N-[2-methyl-3-(4-methylsulfanylpiperidin-1-yl)butyl]cyclopropanamine
CID 114238281
N,N-dimethyl-1-[4-(2-methylpropylamino)butan-2-yl]piperidin-4-amine
CID 62432465
N-[2-methyl-3-(4-propan-2-ylazepan-1-yl)butyl]cyclopropanamine
CID 79409298

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine (CID 79409671) is N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine is CC(C)NCC(C)C(C)N1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine?
The InChIKey is JCYDUSVGOQGBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-12(2)16-11-13(3)14(4)18-9-7-15(8-10-18)17(5)6/h12-16H,7-11H2,1-6H3.
What are the key properties of N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine?
N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine has a molecular weight of 255.45 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine is sourced from PubChem (CID 79409671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).