1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid

C14H24N2O3 — CID 107071305

IUPAC1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
SMILESCC1CCCN(C(=O)N(C)C2CCCC2)C1C(=O)O
InChIInChI=1S/C14H24N2O3/c1-10-6-5-9-16(12(10)13(17)18)14(19)15(2)11-7-3-4-8-11/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyIIMNKHPMTZHXEG-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.17
Rot. Bonds2

About 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid

1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid (PubChem CID 107071305) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
PubChem CID107071305
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
SMILESCC1CCCN(C(=O)N(C)C2CCCC2)C1C(=O)O
InChIInChI=1S/C14H24N2O3/c1-10-6-5-9-16(12(10)13(17)18)14(19)15(2)11-7-3-4-8-11/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyIIMNKHPMTZHXEG-UHFFFAOYSA-N
XLogP2.17
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[cyclopentylmethyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
CID 107071655
1-[cyclopropyl(ethyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
CID 107071301
(2R)-N-cyclohexyl-N,2-dimethylpyrrolidine-1-carboxamide
CID 91128392
1-[bis(cyclopropylmethyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
CID 107071692
3-methyl-1-(2-methylcyclopentanecarbonyl)piperidine-2-carboxylic acid
CID 107175978
1-[(2-ethoxy-2-oxoethyl)-methylcarbamoyl]-3-methylpiperidine-2-carboxylic acid
CID 107071482
3-methyl-1-[methyl(pent-4-enyl)carbamoyl]piperidine-2-carboxylic acid
CID 107071903
1-[methyl-(2-methylcyclohexyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 55004724
1-[3-(dimethylamino)propanoyl]-3-methylpiperidine-2-carboxylic acid
CID 107069454
3-methyl-1-propan-2-yloxycarbonylpiperidine-2-carboxylic acid
CID 107070014
1-[cyclobutyl(2-hydroxyethyl)carbamoyl]-3-methylpyrrolidine-2-carboxylic acid
CID 102865465
(2R)-1-[methyl-(3-methylcyclohexyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 78922898

Frequently Asked Questions

What is the IUPAC name of 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid?
The IUPAC name of 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid (CID 107071305) is 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid.
What is the SMILES notation for 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid?
The canonical SMILES for 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid is CC1CCCN(C(=O)N(C)C2CCCC2)C1C(=O)O.
What is the InChIKey of 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid?
The InChIKey is IIMNKHPMTZHXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-10-6-5-9-16(12(10)13(17)18)14(19)15(2)11-7-3-4-8-11/h10-12H,3-9H2,1-2H3,(H,17,18).
What are the key properties of 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid?
1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclopentyl(methyl)carbamoyl]-3-methylpiperidine-2-carboxylic acid is sourced from PubChem (CID 107071305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).