1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid

C15H17N5O4 — CID 120515028

IUPAC1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid
SMILESCOc1ccc(C(=O)NC2(C(=O)O)CCCC2)cc1-n1cnnn1
InChIInChI=1S/C15H17N5O4/c1-24-12-5-4-10(8-11(12)20-9-16-18-19-20)13(21)17-15(14(22)23)6-2-3-7-15/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,21)(H,22,23)
InChIKeyBGWFJYPYSKRPBQ-UHFFFAOYSA-N
MW331.33 g/mol
LogP0.80
Rot. Bonds5

About 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid

1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 120515028) has the molecular formula C15H17N5O4 and a molecular weight of 331.33 g/mol. Its IUPAC name is 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid
PubChem CID120515028
Molecular FormulaC15H17N5O4
Molecular Weight331.33 g/mol
Exact Mass331.13
IUPAC Name1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid
SMILESCOc1ccc(C(=O)NC2(C(=O)O)CCCC2)cc1-n1cnnn1
InChIInChI=1S/C15H17N5O4/c1-24-12-5-4-10(8-11(12)20-9-16-18-19-20)13(21)17-15(14(22)23)6-2-3-7-15/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,21)(H,22,23)
InChIKeyBGWFJYPYSKRPBQ-UHFFFAOYSA-N
XLogP0.80
TPSA119.23 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.33
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(1-ethylcyclobutyl)-4-methoxy-3-(tetrazol-1-yl)benzamide
CID 75519257
1-[(3-fluoro-4-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43351057
1-[(3-fluoro-4-methoxybenzoyl)amino]cycloheptane-1-carboxylic acid
CID 120538673
7-azaspiro[4.5]decan-7-yl-[4-methoxy-3-(tetrazol-1-yl)phenyl]methanone
CID 139007189
N-[4-methoxy-3-(tetrazol-1-yl)phenyl]acetamide
CID 44615707
1-[[4-(tetrazol-1-yl)benzoyl]amino]cyclopropane-1-carboxylic acid
CID 65452192
3-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]-methylamino]propanoic acid
CID 120524969
N-cyclooctyl-4-methoxy-N-methyl-3-(tetrazol-1-yl)benzamide
CID 75476338
1-[4-[4-methoxy-3-(tetrazol-1-yl)benzoyl]-1,4-diazaspiro[5.5]undecan-1-yl]ethanone
CID 139001313
1-[(3-methoxy-4-methylbenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158397
3,4,5-trimethoxy-N-[4-methoxy-3-(tetrazol-1-yl)phenyl]benzamide
CID 50776858
N-[4-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 167978131

Frequently Asked Questions

What is the IUPAC name of 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid (CID 120515028) is 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid is COc1ccc(C(=O)NC2(C(=O)O)CCCC2)cc1-n1cnnn1.
What is the InChIKey of 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is BGWFJYPYSKRPBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O4/c1-24-12-5-4-10(8-11(12)20-9-16-18-19-20)13(21)17-15(14(22)23)6-2-3-7-15/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,21)(H,22,23).
What are the key properties of 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid?
1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 331.33 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-methoxy-3-(tetrazol-1-yl)benzoyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 120515028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).