2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide

C16H24N2O2 — CID 64911376

IUPAC2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNCC2CCCCC2O)cc1
InChIInChI=1S/C16H24N2O2/c1-12-6-8-14(9-7-12)18-16(20)11-17-10-13-4-2-3-5-15(13)19/h6-9,13,15,17,19H,2-5,10-11H2,1H3,(H,18,20)
InChIKeySDNPEKRRBDMOFV-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.07
Rot. Bonds5

About 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide

2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide (PubChem CID 64911376) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
PubChem CID64911376
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNCC2CCCCC2O)cc1
InChIInChI=1S/C16H24N2O2/c1-12-6-8-14(9-7-12)18-16(20)11-17-10-13-4-2-3-5-15(13)19/h6-9,13,15,17,19H,2-5,10-11H2,1H3,(H,18,20)
InChIKeySDNPEKRRBDMOFV-UHFFFAOYSA-N
XLogP2.07
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)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-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
N-(4-methylphenyl)-2-(oxan-2-ylmethylamino)acetamide
CID 55014055
2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide
CID 64911813
2-[2-(4-methylanilino)-2-oxoethyl]-N-(4-methylphenyl)cyclopentane-1-carboxamide
CID 20735464
2-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-N-(4-methylphenyl)acetamide
CID 60975482
2-[(2-methylcyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 43179972
N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110856796
2-(cyclopropylmethylamino)-N-[4-(2-hydroxycyclohexyl)oxyphenyl]acetamide;hydrochloride
CID 119793780
2-[3-[2-(4-methylanilino)-2-oxoethyl]cyclohexyl]-N-(4-methylphenyl)acetamide
CID 58862999
methyl N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]carbamate
CID 60866405
N-(4-acetamidophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54815392
N-cyclopropyl-3-[[2-(4-methylanilino)-2-oxoethyl]amino]propanamide
CID 79394044

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide (CID 64911376) is 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)CNCC2CCCCC2O)cc1.
What is the InChIKey of 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide?
The InChIKey is SDNPEKRRBDMOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-6-8-14(9-7-12)18-16(20)11-17-10-13-4-2-3-5-15(13)19/h6-9,13,15,17,19H,2-5,10-11H2,1H3,(H,18,20).
What are the key properties of 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide?
2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.07, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 64911376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).