N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide

C16H25N3O — CID 16782283

IUPACN-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(CN)c1)C1CCCCC1
InChIInChI=1S/C16H25N3O/c1-19(15-8-3-2-4-9-15)12-16(20)18-14-7-5-6-13(10-14)11-17/h5-7,10,15H,2-4,8-9,11-12,17H2,1H3,(H,18,20)
InChIKeyUQMNNOLUMHLNCG-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.35
Rot. Bonds5

About N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide

N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide (PubChem CID 16782283) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide
PubChem CID16782283
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(CN)c1)C1CCCCC1
InChIInChI=1S/C16H25N3O/c1-19(15-8-3-2-4-9-15)12-16(20)18-14-7-5-6-13(10-14)11-17/h5-7,10,15H,2-4,8-9,11-12,17H2,1H3,(H,18,20)
InChIKeyUQMNNOLUMHLNCG-UHFFFAOYSA-N
XLogP2.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]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

N-[3-(aminomethyl)phenyl]-2-[methyl-(1-methylpiperidin-3-yl)amino]acetamide
CID 62545512
2-[cyclohexyl(methyl)amino]-N-(3-fluorophenyl)acetamide
CID 4818308
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
2-[cycloheptyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 16577679
N-[3-[[cyclohexyl(methyl)amino]methyl]phenyl]-2-sulfanylacetamide
CID 25257144
N-(3-ethylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607180
N-[3-(aminomethyl)phenyl]-2-(diethylamino)acetamide
CID 16779439
2-[cyclohexyl(methyl)amino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54817312
N-[3-(aminomethyl)phenyl]-4-[cyclobutylmethyl(methyl)amino]butanamide
CID 62862333
N-[4-(aminomethyl)phenyl]-3-[cyclohexyl(methyl)amino]propanamide
CID 16780915
N-[3-(aminomethyl)phenyl]-2-[methyl(3-methylbutan-2-yl)amino]acetamide
CID 43569718
3-[3-(aminomethyl)phenyl]-1-(2-hydroxycyclohexyl)-1-methylurea
CID 102633134

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide?
The IUPAC name of N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide (CID 16782283) is N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide is CN(CC(=O)Nc1cccc(CN)c1)C1CCCCC1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide?
The InChIKey is UQMNNOLUMHLNCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(15-8-3-2-4-9-15)12-16(20)18-14-7-5-6-13(10-14)11-17/h5-7,10,15H,2-4,8-9,11-12,17H2,1H3,(H,18,20).
What are the key properties of N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide?
N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide has a molecular weight of 275.40 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-2-[cyclohexyl(methyl)amino]acetamide is sourced from PubChem (CID 16782283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).