1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide

C15H24N4O — CID 63915230

IUPAC1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide
SMILESN#CC(CN1CCCC(C(N)=O)C1)(NC1CC1)C1CC1
InChIInChI=1S/C15H24N4O/c16-9-15(12-3-4-12,18-13-5-6-13)10-19-7-1-2-11(8-19)14(17)20/h11-13,18H,1-8,10H2,(H2,17,20)
InChIKeySQGOYFDFKGUVLW-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.61
Rot. Bonds6

About 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide

1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide (PubChem CID 63915230) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide
PubChem CID63915230
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide
SMILESN#CC(CN1CCCC(C(N)=O)C1)(NC1CC1)C1CC1
InChIInChI=1S/C15H24N4O/c16-9-15(12-3-4-12,18-13-5-6-13)10-19-7-1-2-11(8-19)14(17)20/h11-13,18H,1-8,10H2,(H2,17,20)
InChIKeySQGOYFDFKGUVLW-UHFFFAOYSA-N
XLogP0.61
TPSA82.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-(cyclopropylamino)-3-(3-methylpyrrolidin-1-yl)propanenitrile
CID 63914415
1-[2-cyano-2-cyclopropyl-2-(propan-2-ylamino)ethyl]-N-methylpiperidine-3-carboxamide
CID 103198001
2-cyclopropyl-2-(cyclopropylamino)-3-(3-ethylpyrrolidin-1-yl)propanenitrile
CID 113418576
1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 42950662
(3R)-1-(2,2-dimethylpropyl)piperidine-3-carboxamide
CID 58877777
1-(2,2-dimethylpropyl)piperidine-3-carboxamide
CID 21060232
1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)piperidine-3-carboxamide
CID 79628715
1-(2-chloroethyl)piperidine-3-carboxamide
CID 61287310
1-(2-hydroxy-2,3-dimethylbutyl)piperidine-3-carboxamide
CID 114447589
1-[3-cyano-3-(methylamino)propyl]piperidine-3-carboxamide
CID 63029052
1-[2-oxo-2-(prop-2-ynylamino)ethyl]piperidine-3-carboxamide
CID 78913114
2-cyclopropyl-3-(3-methylpiperidin-1-yl)-2-(propylamino)propanenitrile
CID 63912194

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide?
The IUPAC name of 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide (CID 63915230) is 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide is N#CC(CN1CCCC(C(N)=O)C1)(NC1CC1)C1CC1.
What is the InChIKey of 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide?
The InChIKey is SQGOYFDFKGUVLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c16-9-15(12-3-4-12,18-13-5-6-13)10-19-7-1-2-11(8-19)14(17)20/h11-13,18H,1-8,10H2,(H2,17,20).
What are the key properties of 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide?
1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 0.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyano-2-cyclopropyl-2-(cyclopropylamino)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 63915230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).