4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide

C15H23N3O — CID 134515265

IUPAC4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide
SMILESCC(C)N1CCC(C)(C(=O)Nc2ccccn2)CC1
InChIInChI=1S/C15H23N3O/c1-12(2)18-10-7-15(3,8-11-18)14(19)17-13-6-4-5-9-16-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,16,17,19)
InChIKeySEDCBCSERDUIPL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.53
Rot. Bonds3

About 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide

4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide (PubChem CID 134515265) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide
PubChem CID134515265
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide
SMILESCC(C)N1CCC(C)(C(=O)Nc2ccccn2)CC1
InChIInChI=1S/C15H23N3O/c1-12(2)18-10-7-15(3,8-11-18)14(19)17-13-6-4-5-9-16-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,16,17,19)
InChIKeySEDCBCSERDUIPL-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-pyridin-2-ylethanone
CID 159270457
N-benzyl-4-methyl-1-propan-2-ylpiperidine-4-carboxamide
CID 139362651
1-(hydroxymethyl)-N-pyridin-2-ylcyclopropane-1-carboxamide
CID 115182071
1-(pyridin-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 62095693
2-chloro-N-pyridin-2-ylpropanamide
CID 16789014
1-acetyl-4-phenyl-N-pyridin-2-ylpiperidine-4-carboxamide
CID 75460001
(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide
CID 124755099
1-methyl-N-[2-(4-propan-2-ylpiperazin-1-yl)-4-pyridinyl]cyclohexane-1-carboxamide
CID 91140414
1-(aminomethyl)-4-methyl-N-pyridin-2-ylcyclohexane-1-carboxamide
CID 113310422
1-propan-2-yl-N-pyridin-2-ylpyrrolidine-2-carboxamide
CID 59706248
3-piperazin-1-yl-N-pyridin-2-ylbutanamide
CID 115189124
4-ethyl-N-phenyl-1-propan-2-ylpiperidine-4-carboxamide
CID 155455844

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide?
The IUPAC name of 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide (CID 134515265) is 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide is CC(C)N1CCC(C)(C(=O)Nc2ccccn2)CC1.
What is the InChIKey of 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide?
The InChIKey is SEDCBCSERDUIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(2)18-10-7-15(3,8-11-18)14(19)17-13-6-4-5-9-16-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,16,17,19).
What are the key properties of 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide?
4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 134515265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).