2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid

C14H24N2O3 — CID 115165465

IUPAC2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid
SMILESCN1CCCC(CCN(C)C(=O)C2CC2C(=O)O)C1
InChIInChI=1S/C14H24N2O3/c1-15-6-3-4-10(9-15)5-7-16(2)13(17)11-8-12(11)14(18)19/h10-12H,3-9H2,1-2H3,(H,18,19)
InChIKeyAWPVJWQXXXGCIC-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.90
Rot. Bonds5

About 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid

2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid (PubChem CID 115165465) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid
PubChem CID115165465
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid
SMILESCN1CCCC(CCN(C)C(=O)C2CC2C(=O)O)C1
InChIInChI=1S/C14H24N2O3/c1-15-6-3-4-10(9-15)5-7-16(2)13(17)11-8-12(11)14(18)19/h10-12H,3-9H2,1-2H3,(H,18,19)
InChIKeyAWPVJWQXXXGCIC-UHFFFAOYSA-N
XLogP0.90
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-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

N-methyl-N-[2-(1-methylpyrrolidin-3-yl)ethyl]carbamoyl chloride
CID 115195122
[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]methanol
CID 115229573
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-2-pyrrolidin-3-ylacetamide
CID 115160418
N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
CID 116845050
3-[methyl-(1-methylpiperidine-3-carbonyl)amino]propanoic acid
CID 110837310
2-(methylamino)-3-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]propanoic acid
CID 115256304
1-methyl-1-[(1-methylpiperidin-3-yl)methyl]urea
CID 115168460
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
CID 117044255
2-[(3R)-1-methylpiperidin-3-yl]acetic acid
CID 67245614
2-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115221459
1-cyano-N-methyl-N-[2-(1-methylpyrrolidin-3-yl)ethyl]formamide
CID 115172736
2-[methyl-(1-methylpiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978705

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid?
The IUPAC name of 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid (CID 115165465) is 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid is CN1CCCC(CCN(C)C(=O)C2CC2C(=O)O)C1.
What is the InChIKey of 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid?
The InChIKey is AWPVJWQXXXGCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-15-6-3-4-10(9-15)5-7-16(2)13(17)11-8-12(11)14(18)19/h10-12H,3-9H2,1-2H3,(H,18,19).
What are the key properties of 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid?
2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid has a molecular weight of 268.36 g/mol, XLogP of 0.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid is sourced from PubChem (CID 115165465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).