1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid

C10H15N5O3 — CID 82760433

IUPAC1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCC1(C(=O)O)CCCC1NC(=O)Cn1cnnn1
InChIInChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-7(10)12-8(16)5-15-6-11-13-14-15/h6-7H,2-5H2,1H3,(H,12,16)(H,17,18)
InChIKeyZHCLVBJZZCIOLB-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.57
Rot. Bonds4

About 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid

1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 82760433) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID82760433
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCC1(C(=O)O)CCCC1NC(=O)Cn1cnnn1
InChIInChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-7(10)12-8(16)5-15-6-11-13-14-15/h6-7H,2-5H2,1H3,(H,12,16)(H,17,18)
InChIKeyZHCLVBJZZCIOLB-UHFFFAOYSA-N
XLogP-0.57
TPSA110.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 83213984
1-methyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 82760350
N-[4-(methylamino)cyclohexyl]-2-(tetrazol-1-yl)acetamide
CID 79111193
1-methyl-2-[3-(triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid
CID 83214056
2-(3-ethoxypropanoylamino)-1-methylcyclopentane-1-carboxylic acid
CID 82760761
2-(4-ethoxybutanoylamino)-1-methylcyclopentane-1-carboxylic acid
CID 82760687
1-methyl-2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 82759878
2-(4,4-dimethylpentanoylamino)-1-methylcyclopentane-1-carboxylic acid
CID 114212381
2-[[2-(4-bromophenyl)acetyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82760341
1-methyl-2-[[2-(prop-2-enylamino)acetyl]amino]cyclopentane-1-carboxylic acid
CID 82763385
2-[[ethyl(phenyl)carbamoyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82764290
N-(1-propanoylazepan-3-yl)-2-(tetrazol-1-yl)acetamide
CID 70733307

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid (CID 82760433) is 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid is CC1(C(=O)O)CCCC1NC(=O)Cn1cnnn1.
What is the InChIKey of 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is ZHCLVBJZZCIOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-7(10)12-8(16)5-15-6-11-13-14-15/h6-7H,2-5H2,1H3,(H,12,16)(H,17,18).
What are the key properties of 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of -0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[[2-(tetrazol-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 82760433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).