1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid

C14H24N2O3 — CID 106744532

IUPAC1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
SMILESCC(CNC(=O)N1CCC(C(=O)O)CC1C)C1CC1
InChIInChI=1S/C14H24N2O3/c1-9(11-3-4-11)8-15-14(19)16-6-5-12(13(17)18)7-10(16)2/h9-12H,3-8H2,1-2H3,(H,15,19)(H,17,18)
InChIKeyXFAXKSWXKNXDNW-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.93
Rot. Bonds4

About 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid

1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid (PubChem CID 106744532) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
PubChem CID106744532
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
SMILESCC(CNC(=O)N1CCC(C(=O)O)CC1C)C1CC1
InChIInChI=1S/C14H24N2O3/c1-9(11-3-4-11)8-15-14(19)16-6-5-12(13(17)18)7-10(16)2/h9-12H,3-8H2,1-2H3,(H,15,19)(H,17,18)
InChIKeyXFAXKSWXKNXDNW-UHFFFAOYSA-N
XLogP1.93
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-1-(2-pyrrolidin-1-ylpropylcarbamoyl)piperidine-4-carboxylic acid
CID 106744451
1-[2-(cyclopropanecarbonylamino)ethylcarbamoyl]-2-methylpiperidine-4-carboxylic acid
CID 106744540
(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 104863962
2-methyl-1-[(1-methylpiperidin-4-yl)methylcarbamoyl]piperidine-4-carboxylic acid
CID 106744198
2-methyl-1-[(2-methylcyclopropyl)carbamoyl]piperidine-4-carboxylic acid
CID 106744253
2-methyl-1-(6-methylheptan-2-ylcarbamoyl)piperidine-4-carboxylic acid
CID 106744109
1-[(4-amino-4-oxobutan-2-yl)carbamoyl]-2-methylpiperidine-4-carboxylic acid
CID 106744558
2-methyl-N-(2-methylpropyl)azetidine-1-carboxamide
CID 130775761
2-methyl-1-[(1-methylsulfanylcyclopropyl)methylcarbamoyl]piperidine-4-carboxylic acid
CID 114116876
2-methyl-1-(4,4,4-trifluorobutylcarbamoyl)piperidine-4-carboxylic acid
CID 106744460
1-(heptan-2-ylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
CID 106744100
1-(tert-butylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
CID 106742306

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid?
The IUPAC name of 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid (CID 106744532) is 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid is CC(CNC(=O)N1CCC(C(=O)O)CC1C)C1CC1.
What is the InChIKey of 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid?
The InChIKey is XFAXKSWXKNXDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-9(11-3-4-11)8-15-14(19)16-6-5-12(13(17)18)7-10(16)2/h9-12H,3-8H2,1-2H3,(H,15,19)(H,17,18).
What are the key properties of 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid?
1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid is sourced from PubChem (CID 106744532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).