N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide

C15H19N5O — CID 42997884

IUPACN-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide
SMILESO=C(NCC1CCCCC1)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H19N5O/c21-15(16-10-12-5-2-1-3-6-12)13-7-4-8-14(9-13)20-11-17-18-19-20/h4,7-9,11-12H,1-3,5-6,10H2,(H,16,21)
InChIKeyKWBOHTLMMLJQKP-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.97
Rot. Bonds4

About N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide

N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide (PubChem CID 42997884) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide
PubChem CID42997884
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC NameN-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide
SMILESO=C(NCC1CCCCC1)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H19N5O/c21-15(16-10-12-5-2-1-3-6-12)13-7-4-8-14(9-13)20-11-17-18-19-20/h4,7-9,11-12H,1-3,5-6,10H2,(H,16,21)
InChIKeyKWBOHTLMMLJQKP-UHFFFAOYSA-N
XLogP1.97
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-3-(tetrazol-1-yl)benzamide
CID 51222719
N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(tetrazol-1-yl)benzamide
CID 51131078
N-(cyclopentylmethyl)-3-[4-(1-methylpyrrolidin-2-yl)triazol-1-yl]benzamide
CID 167819480
N-[(1R,2S)-2-methylcyclohexyl]-3-(tetrazol-1-yl)benzamide
CID 28935459
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(tetrazol-1-yl)benzamide
CID 47005048
N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide
CID 25492900
N-(3,3-diphenylpropyl)-3-(tetrazol-1-yl)benzamide
CID 26881046
N-(2-amino-2-methylpropyl)-3-(tetrazol-1-yl)benzamide;hydrochloride
CID 119627787
3,4-dichloro-N-[2-[[3-(tetrazol-1-yl)benzoyl]amino]ethyl]benzamide
CID 34812905
tert-butyl N-[2-[[3-(tetrazol-1-yl)benzoyl]amino]ethyl]carbamate
CID 51095808
N-(2-amino-1-cyclopropylethyl)-3-(tetrazol-1-yl)benzamide
CID 119614861
N-cycloheptyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 26215976

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide (CID 42997884) is N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide is O=C(NCC1CCCCC1)c1cccc(-n2cnnn2)c1.
What is the InChIKey of N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide?
The InChIKey is KWBOHTLMMLJQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c21-15(16-10-12-5-2-1-3-6-12)13-7-4-8-14(9-13)20-11-17-18-19-20/h4,7-9,11-12H,1-3,5-6,10H2,(H,16,21).
What are the key properties of N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide?
N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide has a molecular weight of 285.35 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 42997884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).