1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide

C17H15N5O — CID 26728537

IUPAC1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(-n2cnnn2)cc1)C1(c2ccccc2)CC1
InChIInChI=1S/C17H15N5O/c23-16(17(10-11-17)13-4-2-1-3-5-13)19-14-6-8-15(9-7-14)22-12-18-20-21-22/h1-9,12H,10-11H2,(H,19,23)
InChIKeyHPWMHYABPOWZGN-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.33
Rot. Bonds4

About 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide

1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide (PubChem CID 26728537) has the molecular formula C17H15N5O and a molecular weight of 305.34 g/mol. Its IUPAC name is 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide
PubChem CID26728537
Molecular FormulaC17H15N5O
Molecular Weight305.34 g/mol
Exact Mass305.13
IUPAC Name1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(-n2cnnn2)cc1)C1(c2ccccc2)CC1
InChIInChI=1S/C17H15N5O/c23-16(17(10-11-17)13-4-2-1-3-5-13)19-14-6-8-15(9-7-14)22-12-18-20-21-22/h1-9,12H,10-11H2,(H,19,23)
InChIKeyHPWMHYABPOWZGN-UHFFFAOYSA-N
XLogP2.33
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 55993279
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CID 64892992
1-(4-bromophenyl)-N-[2-fluoro-5-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide
CID 55813866
2-(2-chlorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
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N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide
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4-phenoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
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N-[4-(3,5-dicyclopropylpyrazol-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide
CID 51352847
3-chloro-N-[4-(tetrazol-1-yl)phenyl]propanamide
CID 43167870
2,3-dimethyl-4-oxo-4-[4-(tetrazol-1-yl)anilino]but-2-enoic acid
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2-(4-phenoxyphenoxy)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55500018
2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(tetrazol-1-yl)phenyl]acetamide
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2-(cyclopropylmethylamino)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 61261084

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide (CID 26728537) is 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide is O=C(Nc1ccc(-n2cnnn2)cc1)C1(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide?
The InChIKey is HPWMHYABPOWZGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O/c23-16(17(10-11-17)13-4-2-1-3-5-13)19-14-6-8-15(9-7-14)22-12-18-20-21-22/h1-9,12H,10-11H2,(H,19,23).
What are the key properties of 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide?
1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[4-(tetrazol-1-yl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 26728537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).