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

C15H17N5O — CID 25492900

IUPACN-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide
SMILESO=C(NC(C1CC1)C1CC1)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H17N5O/c21-15(17-14(10-4-5-10)11-6-7-11)12-2-1-3-13(8-12)20-9-16-18-19-20/h1-3,8-11,14H,4-7H2,(H,17,21)
InChIKeyNYSGOIKXMQGNCV-UHFFFAOYSA-N
MW283.33 g/mol
LogP1.58
Rot. Bonds5

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

N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide (PubChem CID 25492900) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide
PubChem CID25492900
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC NameN-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide
SMILESO=C(NC(C1CC1)C1CC1)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H17N5O/c21-15(17-14(10-4-5-10)11-6-7-11)12-2-1-3-13(8-12)20-9-16-18-19-20/h1-3,8-11,14H,4-7H2,(H,17,21)
InChIKeyNYSGOIKXMQGNCV-UHFFFAOYSA-N
XLogP1.58
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-3-(tetrazol-1-yl)benzamide
CID 119614861
N-butan-2-yl-3-(tetrazol-1-yl)benzamide
CID 42651210
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-(tetrazol-1-yl)benzamide
CID 18271808
N-(1-methoxypropan-2-yl)-3-(tetrazol-1-yl)benzamide
CID 47005557
N-(cyclohexylmethyl)-3-(tetrazol-1-yl)benzamide
CID 42997884
(2S)-4-methyl-2-[[3-(tetrazol-1-yl)benzoyl]amino]pentanoic acid
CID 119361740
N-[(1R,2S)-2-methylcyclohexyl]-3-(tetrazol-1-yl)benzamide
CID 28935459
N-[(2R)-heptan-2-yl]-3-(tetrazol-1-yl)benzamide
CID 28935486
N-(3-acetylphenyl)-3-(tetrazol-1-yl)benzamide
CID 862153
N-[(2R)-4-phenylbutan-2-yl]-3-(tetrazol-1-yl)benzamide
CID 42535237
N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(tetrazol-1-yl)benzamide
CID 26171953
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-3-(tetrazol-1-yl)benzamide
CID 51126901

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide (CID 25492900) is N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide is O=C(NC(C1CC1)C1CC1)c1cccc(-n2cnnn2)c1.
What is the InChIKey of N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide?
The InChIKey is NYSGOIKXMQGNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c21-15(17-14(10-4-5-10)11-6-7-11)12-2-1-3-13(8-12)20-9-16-18-19-20/h1-3,8-11,14H,4-7H2,(H,17,21).
What are the key properties of N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide?
N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide has a molecular weight of 283.33 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 25492900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).