2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide

C20H30N4O2 — CID 55365381

IUPAC2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide
SMILESCN(Cc1ccccc1NCC(=O)NC(=O)NC1CC1)C1CCCCC1
InChIInChI=1S/C20H30N4O2/c1-24(17-8-3-2-4-9-17)14-15-7-5-6-10-18(15)21-13-19(25)23-20(26)22-16-11-12-16/h5-7,10,16-17,21H,2-4,8-9,11-14H2,1H3,(H2,22,23,25,26)
InChIKeyIQJXQSULPPDHEG-UHFFFAOYSA-N
MW358.49 g/mol
LogP2.85
Rot. Bonds7

About 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide

2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide (PubChem CID 55365381) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide
PubChem CID55365381
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC Name2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide
SMILESCN(Cc1ccccc1NCC(=O)NC(=O)NC1CC1)C1CCCCC1
InChIInChI=1S/C20H30N4O2/c1-24(17-8-3-2-4-9-17)14-15-7-5-6-10-18(15)21-13-19(25)23-20(26)22-16-11-12-16/h5-7,10,16-17,21H,2-4,8-9,11-14H2,1H3,(H2,22,23,25,26)
InChIKeyIQJXQSULPPDHEG-UHFFFAOYSA-N
XLogP2.85
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide 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-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(2-methylbutan-2-yl)acetamide
CID 32901720
2-[2-[[2-(cyclopropylcarbamoylamino)-2-oxoethyl]amino]phenyl]-N,N-dimethylacetamide
CID 47077671
2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylmethyl)acetamide
CID 78842111
2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-1-(3-methylpiperidin-1-yl)ethanone
CID 55345437
2-[cyclohexyl(methyl)amino]-N-(cyclopropylcarbamoyl)acetamide
CID 40706155
N-cycloheptyl-2-(2-ethylanilino)acetamide
CID 60631370
2-(2-bromoanilino)-N-(cyclopropylcarbamoyl)acetamide
CID 42069187
2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]acetamide
CID 24510760
N-(3-cyanophenyl)-2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]acetamide
CID 9104665
2-[cyclopentyl(methyl)amino]-N-(cyclopropylcarbamoyl)acetamide
CID 47126757
2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]amino]benzamide
CID 16606580
3-[[2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]acetyl]amino]-N-ethylbenzamide
CID 41391031

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide?
The IUPAC name of 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide (CID 55365381) is 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide.
What is the SMILES notation for 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide?
The canonical SMILES for 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide is CN(Cc1ccccc1NCC(=O)NC(=O)NC1CC1)C1CCCCC1.
What is the InChIKey of 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide?
The InChIKey is IQJXQSULPPDHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-24(17-8-3-2-4-9-17)14-15-7-5-6-10-18(15)21-13-19(25)23-20(26)22-16-11-12-16/h5-7,10,16-17,21H,2-4,8-9,11-14H2,1H3,(H2,22,23,25,26).
What are the key properties of 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide?
2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide has a molecular weight of 358.49 g/mol, XLogP of 2.85, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[cyclohexyl(methyl)amino]methyl]anilino]-N-(cyclopropylcarbamoyl)acetamide is sourced from PubChem (CID 55365381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).