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

C11H17NO3 — CID 107175622

IUPAC1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
SMILESCC1CCCC1C(=O)NC1(C(=O)O)CC1
InChIInChI=1S/C11H17NO3/c1-7-3-2-4-8(7)9(13)12-11(5-6-11)10(14)15/h7-8H,2-6H2,1H3,(H,12,13)(H,14,15)
InChIKeyKKTJJVXYXGLXCQ-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.16
Rot. Bonds3

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

1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid (PubChem CID 107175622) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
PubChem CID107175622
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid
SMILESCC1CCCC1C(=O)NC1(C(=O)O)CC1
InChIInChI=1S/C11H17NO3/c1-7-3-2-4-8(7)9(13)12-11(5-6-11)10(14)15/h7-8H,2-6H2,1H3,(H,12,13)(H,14,15)
InChIKeyKKTJJVXYXGLXCQ-UHFFFAOYSA-N
XLogP1.16
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-methylcyclohexanecarbonyl)amino]cyclopropane-1-carboxylic acid
CID 122129367
1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 107175126
1-[(3-methyloxane-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 114240909
1-[(2-methyloxolane-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 79750991
1-[(2-aminocyclopentanecarbonyl)amino]-3-methylcyclohexane-1-carboxylic acid
CID 64823648
1-(cyclopentanecarbonylamino)-4-methylcyclohexane-1-carboxylic acid
CID 43341471
cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143706762
2-methylcyclooctane-1-carboxylic acid
CID 21039885
4-methyl-1-[(3-methylpiperidine-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 107067899
N-[4-(chloromethyl)oxan-4-yl]-2-methylcyclopentane-1-carboxamide
CID 106300635
N-[4-(aminomethyl)oxan-4-yl]-2-methylcyclopentane-1-carboxamide
CID 106297417
2-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 107175594

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid?
The IUPAC name of 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid (CID 107175622) is 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid.
What is the SMILES notation for 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid?
The canonical SMILES for 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid is CC1CCCC1C(=O)NC1(C(=O)O)CC1.
What is the InChIKey of 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid?
The InChIKey is KKTJJVXYXGLXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-7-3-2-4-8(7)9(13)12-11(5-6-11)10(14)15/h7-8H,2-6H2,1H3,(H,12,13)(H,14,15).
What are the key properties of 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid?
1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopentanecarbonyl)amino]cyclopropane-1-carboxylic acid is sourced from PubChem (CID 107175622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).