1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid

C10H17NO4 — CID 22574849

IUPAC1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
SMILESCOCCC(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C10H17NO4/c1-15-7-4-8(12)11-10(9(13)14)5-2-3-6-10/h2-7H2,1H3,(H,11,12)(H,13,14)
InChIKeyUCHAHGNGQBBXEP-UHFFFAOYSA-N
MW215.25 g/mol
LogP0.54
Rot. Bonds5

About 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid

1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid (PubChem CID 22574849) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
PubChem CID22574849
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
SMILESCOCCC(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C10H17NO4/c1-15-7-4-8(12)11-10(9(13)14)5-2-3-6-10/h2-7H2,1H3,(H,11,12)(H,13,14)
InChIKeyUCHAHGNGQBBXEP-UHFFFAOYSA-N
XLogP0.54
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(2-methoxyethoxy)propanoylamino]cycloheptane-1-carboxylic acid
CID 120539104
1-[3-(2-methoxyethoxy)propanoylamino]cyclopropane-1-carboxylic acid
CID 115910125
1-(3-carboxypropanoylamino)cyclopentane-1-carboxylic acid
CID 13376659
N-[1-(N'-hydroxycarbamimidoyl)cyclopentyl]-3-methoxypropanamide
CID 76946958
1-(butanoylamino)cyclobutane-1-carboxylic acid
CID 81158952
1-(4-ethoxybutanoylamino)cyclohexane-1-carboxylic acid
CID 112729272
1-[3-(propan-2-ylamino)propanoylamino]cyclopentane-1-carboxylic acid
CID 61160411
2-[1-(3-methoxypropanoylamino)cyclohexyl]acetic acid
CID 64672330
1-(3-methoxypropanoylamino)-2-methylcyclohexane-1-carboxylic acid
CID 62590402
1-[(3-methoxypropanoylamino)methyl]cyclopentane-1-carboxylic acid
CID 81362446
1-(hexanoylamino)cycloheptane-1-carboxylic acid
CID 43341577
1-(pentanoylamino)cyclobutane-1-carboxylic acid
CID 81164926

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid (CID 22574849) is 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid is COCCC(=O)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid?
The InChIKey is UCHAHGNGQBBXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-15-7-4-8(12)11-10(9(13)14)5-2-3-6-10/h2-7H2,1H3,(H,11,12)(H,13,14).
What are the key properties of 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid?
1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid has a molecular weight of 215.25 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 22574849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).