1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid

C12H19NO3 — CID 106703092

IUPAC1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCC1(C)CC1C(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C12H19NO3/c1-11(2)7-8(11)9(14)13-12(10(15)16)5-3-4-6-12/h8H,3-7H2,1-2H3,(H,13,14)(H,15,16)
InChIKeyAXSRHAWPZWGSOH-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.55
Rot. Bonds3

About 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid

1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 106703092) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID106703092
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCC1(C)CC1C(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C12H19NO3/c1-11(2)7-8(11)9(14)13-12(10(15)16)5-3-4-6-12/h8H,3-7H2,1-2H3,(H,13,14)(H,15,16)
InChIKeyAXSRHAWPZWGSOH-UHFFFAOYSA-N
XLogP1.55
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 106703045
1-[[(1S)-2,2-dimethylcyclopropanecarbonyl]amino]cyclohexane-1-carboxylic acid
CID 120666263
1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclobutane-1-carboxylic acid
CID 106703650
N-[1-(hydroxymethyl)cyclobutyl]-2,2-dimethylcyclopropane-1-carboxamide
CID 103881165
1-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 107175126
N-[1-(aminomethyl)cyclohexyl]-2,2-dimethylcyclopropane-1-carboxamide
CID 107003388
1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid
CID 81158706
4-methyl-1-(spiro[2.2]pentane-2-carbonylamino)cyclohexane-1-carboxylic acid
CID 122108091
1-(bicyclo[4.1.0]heptane-7-carbonylamino)cyclohexane-1-carboxylic acid
CID 81356177
1-[(2-methyloxolane-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 79750991
1-[(1-acetylpiperidine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 120539156
1-(thiane-4-carbonylamino)cycloheptane-1-carboxylic acid
CID 120538857

Frequently Asked Questions

What is the IUPAC name of 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid (CID 106703092) is 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid is CC1(C)CC1C(=O)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is AXSRHAWPZWGSOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-11(2)7-8(11)9(14)13-12(10(15)16)5-3-4-6-12/h8H,3-7H2,1-2H3,(H,13,14)(H,15,16).
What are the key properties of 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid?
1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 225.29 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,2-dimethylcyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 106703092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).