N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide

C21H24N6O — CID 46974306

IUPACN-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)N(Cc1ccccn1)C1CCCCC1
InChIInChI=1S/C21H24N6O/c28-20(16-27-24-21(23-25-27)17-9-3-1-4-10-17)26(19-12-5-2-6-13-19)15-18-11-7-8-14-22-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2
InChIKeyPOVXMGFEUNHYNA-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.10
Rot. Bonds6

About N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide

N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 46974306) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID46974306
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC NameN-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)N(Cc1ccccn1)C1CCCCC1
InChIInChI=1S/C21H24N6O/c28-20(16-27-24-21(23-25-27)17-9-3-1-4-10-17)26(19-12-5-2-6-13-19)15-18-11-7-8-14-22-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2
InChIKeyPOVXMGFEUNHYNA-UHFFFAOYSA-N
XLogP3.10
TPSA76.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclohexyl-2-(3,5-dimethyl-N-[2-(5-phenyltetrazol-2-yl)acetyl]anilino)-2-pyridin-2-ylacetamide
CID 3181617
N-cyclohexyl-N-(pyridin-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 74234463
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-cyclopentyl-N-[2-(cyclopentylamino)-2-oxoethyl]acetamide
CID 3179691
N-cyclopropyl-N-(pyridin-2-ylmethyl)propanamide
CID 60668331
2-(5-phenyltetrazol-2-yl)acetic acid
CID 1086563
N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7702610
N-cyclohexyl-N-[2-(cyclopentylamino)-2-oxoethyl]-2-[5-(3,4-dichlorophenyl)tetrazol-2-yl]acetamide
CID 53377417
N-cyclohexyl-1-methyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 74232119
N-(azepan-4-yl)-N-(pyridin-2-ylmethyl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 126768569
N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine
CID 71881409
N-methyl-2-(5-phenyltetrazol-2-yl)-N-(2-piperidin-1-ylethyl)acetamide
CID 46981616
N-cyclopropyl-3-(cyclopropylamino)-N-(pyridin-2-ylmethyl)propanamide
CID 54869688

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide (CID 46974306) is N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide is O=C(Cn1nnc(-c2ccccc2)n1)N(Cc1ccccn1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is POVXMGFEUNHYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c28-20(16-27-24-21(23-25-27)17-9-3-1-4-10-17)26(19-12-5-2-6-13-19)15-18-11-7-8-14-22-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2.
What are the key properties of N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 376.46 g/mol, XLogP of 3.10, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(5-phenyltetrazol-2-yl)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 46974306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).