2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide

C15H31N3O — CID 81334194

IUPAC2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide
SMILESCC(C)CC(NC1CCN(C)C(C)C1)C(=O)N(C)C
InChIInChI=1S/C15H31N3O/c1-11(2)9-14(15(19)17(4)5)16-13-7-8-18(6)12(3)10-13/h11-14,16H,7-10H2,1-6H3
InChIKeyXCBCJPSMXGWLCQ-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.56
Rot. Bonds5

About 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide

2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide (PubChem CID 81334194) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide.

Molecular Properties

Compound Name2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide
PubChem CID81334194
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide
SMILESCC(C)CC(NC1CCN(C)C(C)C1)C(=O)N(C)C
InChIInChI=1S/C15H31N3O/c1-11(2)9-14(15(19)17(4)5)16-13-7-8-18(6)12(3)10-13/h11-14,16H,7-10H2,1-6H3
InChIKeyXCBCJPSMXGWLCQ-UHFFFAOYSA-N
XLogP1.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,4-trimethyl-2-[(1-propylpiperidin-4-yl)amino]pentanamide
CID 43674980
2-[(4-aminocyclohexyl)amino]-N,N,4-trimethylpentanamide
CID 79723960
N,N,4-trimethyl-2-[(4-methylcycloheptyl)amino]pentanamide
CID 65080591
2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide
CID 112554585
N-(3,3-dimethylbutan-2-yl)-1,2-dimethylpiperidin-4-amine
CID 115719082
(2R)-1-[(1,2-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906841
(2S)-1-[(1,2-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906506
1,2-dimethyl-N-pent-4-yn-2-ylpiperidin-4-amine
CID 115725209
2-(1,2-dimethylpiperidin-4-yl)-1,1-dimethylhydrazine
CID 83005430
4-methyl-2-[(3-methylcyclopentyl)amino]pentanoic acid
CID 64501348
1,2-dimethyl-N-[1-(1-methylpiperidin-4-yl)ethyl]piperidin-4-amine
CID 81343455
2-[(2-methoxycyclohexyl)amino]-N,N,4-trimethylpentanamide
CID 43779376

Frequently Asked Questions

What is the IUPAC name of 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide?
The IUPAC name of 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide (CID 81334194) is 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide.
What is the SMILES notation for 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide?
The canonical SMILES for 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide is CC(C)CC(NC1CCN(C)C(C)C1)C(=O)N(C)C.
What is the InChIKey of 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide?
The InChIKey is XCBCJPSMXGWLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-11(2)9-14(15(19)17(4)5)16-13-7-8-18(6)12(3)10-13/h11-14,16H,7-10H2,1-6H3.
What are the key properties of 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide?
2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide has a molecular weight of 269.43 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,2-dimethylpiperidin-4-yl)amino]-N,N,4-trimethylpentanamide is sourced from PubChem (CID 81334194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).