6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide

C16H24N2O2 — CID 54855992

IUPAC6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CCCC(C)N2)cc1
InChIInChI=1S/C16H24N2O2/c1-3-11-20-14-9-7-13(8-10-14)18-16(19)15-6-4-5-12(2)17-15/h7-10,12,15,17H,3-6,11H2,1-2H3,(H,18,19)
InChIKeyPGUOXJDSWKWIPW-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.94
Rot. Bonds5

About 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide

6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide (PubChem CID 54855992) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide
PubChem CID54855992
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CCCC(C)N2)cc1
InChIInChI=1S/C16H24N2O2/c1-3-11-20-14-9-7-13(8-10-14)18-16(19)15-6-4-5-12(2)17-15/h7-10,12,15,17H,3-6,11H2,1-2H3,(H,18,19)
InChIKeyPGUOXJDSWKWIPW-UHFFFAOYSA-N
XLogP2.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-butoxyphenyl)-6-methylpiperidine-2-carboxamide
CID 54856149
1-cyclopentyl-3-(4-propoxyphenyl)urea
CID 110774502
3-amino-N-(4-propoxyphenyl)cyclohexane-1-carboxamide
CID 63045073
4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
CID 62327297
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
4,4-difluoro-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 120955356
(2R,5S)-5-[(4-propoxyphenyl)carbamoyl]oxolane-2-carboxylic acid
CID 102945175
methyl 4-[4-(pyrrolidine-2-carbonylamino)phenoxy]butanoate
CID 119323990
2-piperidin-4-yloxy-N-(4-propoxyphenyl)acetamide
CID 63876932
N-[(4-propoxyphenyl)carbamothioyl]cyclohexanecarboxamide
CID 4943225
(2R)-N-[4-[2-(dimethylamino)ethoxy]phenyl]piperidine-2-carboxamide
CID 103813549
1-ethyl-3-(4-propoxyphenyl)urea
CID 115881886

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide?
The IUPAC name of 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide (CID 54855992) is 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide?
The canonical SMILES for 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide is CCCOc1ccc(NC(=O)C2CCCC(C)N2)cc1.
What is the InChIKey of 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide?
The InChIKey is PGUOXJDSWKWIPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-11-20-14-9-7-13(8-10-14)18-16(19)15-6-4-5-12(2)17-15/h7-10,12,15,17H,3-6,11H2,1-2H3,(H,18,19).
What are the key properties of 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide?
6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide is sourced from PubChem (CID 54855992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).