N-piperidin-4-ylazetidine-3-carboxamide

C9H17N3O — CID 123647317

IUPACN-piperidin-4-ylazetidine-3-carboxamide
SMILESO=C(NC1CCNCC1)C1CNC1
InChIInChI=1S/C9H17N3O/c13-9(7-5-11-6-7)12-8-1-3-10-4-2-8/h7-8,10-11H,1-6H2,(H,12,13)
InChIKeyMVAHFOQPVQDXFV-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.93
Rot. Bonds2

About N-piperidin-4-ylazetidine-3-carboxamide

N-piperidin-4-ylazetidine-3-carboxamide (PubChem CID 123647317) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-piperidin-4-ylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-piperidin-4-ylazetidine-3-carboxamide
PubChem CID123647317
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-piperidin-4-ylazetidine-3-carboxamide
SMILESO=C(NC1CCNCC1)C1CNC1
InChIInChI=1S/C9H17N3O/c13-9(7-5-11-6-7)12-8-1-3-10-4-2-8/h7-8,10-11H,1-6H2,(H,12,13)
InChIKeyMVAHFOQPVQDXFV-UHFFFAOYSA-N
XLogP-0.93
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-4-ylcyclopropanecarboxamide
CID 1445166
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
N-(azepan-4-yl)cyclohexanecarboxamide
CID 105059767
4-oxo-N-piperidin-4-ylcyclohexane-1-carboxamide
CID 112531105
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296
2,2,3,3-tetramethyl-N-piperidin-4-ylcyclopropane-1-carboxamide
CID 66477619
(3S)-N-cyclopropylpyrrolidine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 171930235
N-(azepan-4-yl)-4,4-difluorocyclohexane-1-carboxamide
CID 107172304
N-[(3S)-pyrrolidin-3-yl]oxane-4-carboxamide
CID 79688091

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-ylazetidine-3-carboxamide?
The IUPAC name of N-piperidin-4-ylazetidine-3-carboxamide (CID 123647317) is N-piperidin-4-ylazetidine-3-carboxamide.
What is the SMILES notation for N-piperidin-4-ylazetidine-3-carboxamide?
The canonical SMILES for N-piperidin-4-ylazetidine-3-carboxamide is O=C(NC1CCNCC1)C1CNC1.
What is the InChIKey of N-piperidin-4-ylazetidine-3-carboxamide?
The InChIKey is MVAHFOQPVQDXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c13-9(7-5-11-6-7)12-8-1-3-10-4-2-8/h7-8,10-11H,1-6H2,(H,12,13).
What are the key properties of N-piperidin-4-ylazetidine-3-carboxamide?
N-piperidin-4-ylazetidine-3-carboxamide has a molecular weight of 183.25 g/mol, XLogP of -0.93, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-ylazetidine-3-carboxamide is sourced from PubChem (CID 123647317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).