N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide

C19H21N7O — CID 47066462

IUPACN-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide
SMILESCc1cccc(NC(=O)C2CCCN(c3nnnn3-c3ccccc3)C2)n1
InChIInChI=1S/C19H21N7O/c1-14-7-5-11-17(20-14)21-18(27)15-8-6-12-25(13-15)19-22-23-24-26(19)16-9-3-2-4-10-16/h2-5,7,9-11,15H,6,8,12-13H2,1H3,(H,20,21,27)
InChIKeyOAMWHLWKAHLQIN-UHFFFAOYSA-N
MW363.43 g/mol
LogP2.22
Rot. Bonds4

About N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide

N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide (PubChem CID 47066462) has the molecular formula C19H21N7O and a molecular weight of 363.43 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide
PubChem CID47066462
Molecular FormulaC19H21N7O
Molecular Weight363.43 g/mol
Exact Mass363.18
IUPAC NameN-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide
SMILESCc1cccc(NC(=O)C2CCCN(c3nnnn3-c3ccccc3)C2)n1
InChIInChI=1S/C19H21N7O/c1-14-7-5-11-17(20-14)21-18(27)15-8-6-12-25(13-15)19-22-23-24-26(19)16-9-3-2-4-10-16/h2-5,7,9-11,15H,6,8,12-13H2,1H3,(H,20,21,27)
InChIKeyOAMWHLWKAHLQIN-UHFFFAOYSA-N
XLogP2.22
TPSA88.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.43
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(6-methyl-2-pyridinyl)-1-[(1-phenyltetrazol-5-yl)methyl]piperidine-3-carboxamide
CID 87008642
1-[1-(4-methylphenyl)tetrazol-5-yl]piperidine-3-carboxylic acid
CID 122051249
1-[4-methyl-5-(naphthalen-2-ylmethyl)-1,2,4-triazol-3-yl]-N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 167955174
(3R)-N-(6-methyl-2-pyridinyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 36998696
N-(6-methyl-2-pyridinyl)-1-[6-(2-phenylimidazol-1-yl)pyridazin-3-yl]piperidine-3-carboxamide
CID 121104008
(3S)-N-(cyclopropylmethyl)-1-[1-(4-methylphenyl)tetrazol-5-yl]piperidine-3-carboxamide
CID 94521674
N-methyl-1-(1-phenyltetrazol-5-yl)piperidin-3-amine
CID 55084372
1-(1-phenyltetrazol-5-yl)piperidin-3-ol
CID 18074907
(3R)-1-[(2R)-1-amino-1-oxopropan-2-yl]-N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 124818575
1-N,4-N-bis(6-methyl-2-pyridinyl)cyclohexane-1,4-dicarboxamide
CID 25469709
1-(2-chlorobenzoyl)-N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 55813036
methyl 2-methyl-2-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]propanoate
CID 133444460

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide (CID 47066462) is N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide is Cc1cccc(NC(=O)C2CCCN(c3nnnn3-c3ccccc3)C2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide?
The InChIKey is OAMWHLWKAHLQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7O/c1-14-7-5-11-17(20-14)21-18(27)15-8-6-12-25(13-15)19-22-23-24-26(19)16-9-3-2-4-10-16/h2-5,7,9-11,15H,6,8,12-13H2,1H3,(H,20,21,27).
What are the key properties of N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide?
N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide has a molecular weight of 363.43 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-1-(1-phenyltetrazol-5-yl)piperidine-3-carboxamide is sourced from PubChem (CID 47066462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).