1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid

C15H26N2O3 — CID 65241928

IUPAC1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCNC1(CC(=O)NC2(C(=O)O)CCCC2)CCCCC1
InChIInChI=1S/C15H26N2O3/c1-16-14(7-3-2-4-8-14)11-12(18)17-15(13(19)20)9-5-6-10-15/h16H,2-11H2,1H3,(H,17,18)(H,19,20)
InChIKeyAYJRQPUBNTZCNI-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.81
Rot. Bonds5

About 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid

1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 65241928) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID65241928
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCNC1(CC(=O)NC2(C(=O)O)CCCC2)CCCCC1
InChIInChI=1S/C15H26N2O3/c1-16-14(7-3-2-4-8-14)11-12(18)17-15(13(19)20)9-5-6-10-15/h16H,2-11H2,1H3,(H,17,18)(H,19,20)
InChIKeyAYJRQPUBNTZCNI-UHFFFAOYSA-N
XLogP1.81
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(hydroxymethyl)cyclopentyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242231
2-[1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentyl]acetic acid
CID 65241615
N-ethyl-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240911
3-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]propanoic acid
CID 65242262
1-[(3-amino-3-methylbutanoyl)amino]cyclohexane-1-carboxylic acid
CID 64676761
1-(hexanoylamino)cycloheptane-1-carboxylic acid
CID 43341577
1-(3-carboxypropanoylamino)cyclopentane-1-carboxylic acid
CID 13376659
1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
CID 22574849
1-(nonanoylamino)cyclohexane-1-carboxylic acid
CID 43350921
1-[[2-(1-adamantyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 131919775
1-(nonanoylamino)cycloheptane-1-carboxylic acid
CID 43172633
1-[[2-(methylamino)-2-oxoethyl]carbamoylamino]cycloheptane-1-carboxylic acid
CID 61199319

Frequently Asked Questions

What is the IUPAC name of 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid (CID 65241928) is 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid is CNC1(CC(=O)NC2(C(=O)O)CCCC2)CCCCC1.
What is the InChIKey of 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is AYJRQPUBNTZCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-16-14(7-3-2-4-8-14)11-12(18)17-15(13(19)20)9-5-6-10-15/h16H,2-11H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid?
1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 282.38 g/mol, XLogP of 1.81, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 65241928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).