1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid

C12H20N2O3 — CID 82767462

IUPAC1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid
SMILESCC1(C(=O)NC2(C(=O)O)CCC2)CCCC1N
InChIInChI=1S/C12H20N2O3/c1-11(5-2-4-8(11)13)9(15)14-12(10(16)17)6-3-7-12/h8H,2-7,13H2,1H3,(H,14,15)(H,16,17)
InChIKeyWYGFUIYGHSBYJO-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.63
Rot. Bonds3

About 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid

1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid (PubChem CID 82767462) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid
PubChem CID82767462
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid
SMILESCC1(C(=O)NC2(C(=O)O)CCC2)CCCC1N
InChIInChI=1S/C12H20N2O3/c1-11(5-2-4-8(11)13)9(15)14-12(10(16)17)6-3-7-12/h8H,2-7,13H2,1H3,(H,14,15)(H,16,17)
InChIKeyWYGFUIYGHSBYJO-UHFFFAOYSA-N
XLogP0.63
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
CID 82767722
1-[(2-amino-1-methylcyclopentanecarbonyl)amino]-4-ethylcyclohexane-1-carboxylic acid
CID 82758308
3-[(2-amino-1-methylcyclopentanecarbonyl)amino]oxolane-3-carboxylic acid
CID 82768356
(1R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 129318014
trans-(1S,2R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 55284582
(2S)-2-amino-1-methylcyclohexane-1-carboxylic acid
CID 67285208
2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314913
trans-(1S,2R)-2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314910
2-amino-1-methyl-N-(4-methylcyclohexyl)cyclopentane-1-carboxamide
CID 82765593
2-amino-N-(3-ethylpentan-3-yl)-1-methylcyclopentane-1-carboxamide
CID 82767363
3-[(2-amino-1-methylcyclopentanecarbonyl)amino]butanoic acid
CID 82768685
2-amino-N-(cyanomethyl)-1-methylcyclopentane-1-carboxamide
CID 82767784

Frequently Asked Questions

What is the IUPAC name of 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid?
The IUPAC name of 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid (CID 82767462) is 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid.
What is the SMILES notation for 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid?
The canonical SMILES for 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid is CC1(C(=O)NC2(C(=O)O)CCC2)CCCC1N.
What is the InChIKey of 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid?
The InChIKey is WYGFUIYGHSBYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-11(5-2-4-8(11)13)9(15)14-12(10(16)17)6-3-7-12/h8H,2-7,13H2,1H3,(H,14,15)(H,16,17).
What are the key properties of 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid?
1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid has a molecular weight of 240.30 g/mol, XLogP of 0.63, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-amino-1-methylcyclopentanecarbonyl)amino]cyclobutane-1-carboxylic acid is sourced from PubChem (CID 82767462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).