N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide

C15H22N2O3 — CID 106593678

IUPACN-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide
SMILESCOc1cc(NC2CCC(O)CC2)ccc1NC(C)=O
InChIInChI=1S/C15H22N2O3/c1-10(18)16-14-8-5-12(9-15(14)20-2)17-11-3-6-13(19)7-4-11/h5,8-9,11,13,17,19H,3-4,6-7H2,1-2H3,(H,16,18)
InChIKeyWWLVHBRPQXLUNH-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.37
Rot. Bonds4

About N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide

N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide (PubChem CID 106593678) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide
PubChem CID106593678
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide
SMILESCOc1cc(NC2CCC(O)CC2)ccc1NC(C)=O
InChIInChI=1S/C15H22N2O3/c1-10(18)16-14-8-5-12(9-15(14)20-2)17-11-3-6-13(19)7-4-11/h5,8-9,11,13,17,19H,3-4,6-7H2,1-2H3,(H,16,18)
InChIKeyWWLVHBRPQXLUNH-UHFFFAOYSA-N
XLogP2.37
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methoxy-4-[(1-methylpiperidin-4-yl)amino]phenyl]acetamide
CID 43672947
4-(3,4-dimethoxyanilino)cyclohexan-1-ol
CID 82539356
N-[4-[(1-ethylpiperidin-4-yl)amino]-2-methoxyphenyl]acetamide
CID 43672950
N-[4-[(3-aminocyclohexyl)amino]-2-methoxyphenyl]acetamide
CID 79458739
4-(3-ethyl-4-methoxyanilino)cyclohexan-1-ol
CID 115149340
4-(3-ethoxy-4-methoxyanilino)cyclohexan-1-ol
CID 106594039
methyl N-[4-[(4-hydroxycyclohexyl)amino]phenyl]carbamate
CID 106594042
N-(4-acetamido-3-methoxyphenyl)cyclohexanecarboxamide
CID 53491142
N-(4-formamido-2-methoxyphenyl)acetamide
CID 64990664
N-[2-methyl-4-[(4-methylcyclohexyl)amino]phenyl]acetamide
CID 43672817
N-[4-(4-methoxy-3-propan-2-yloxyanilino)cyclohexyl]acetamide
CID 99635767
N-(4-acetamido-3-methoxyphenyl)-2-methoxypropanamide
CID 47308212

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide?
The IUPAC name of N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide (CID 106593678) is N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide.
What is the SMILES notation for N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide?
The canonical SMILES for N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide is COc1cc(NC2CCC(O)CC2)ccc1NC(C)=O.
What is the InChIKey of N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide?
The InChIKey is WWLVHBRPQXLUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10(18)16-14-8-5-12(9-15(14)20-2)17-11-3-6-13(19)7-4-11/h5,8-9,11,13,17,19H,3-4,6-7H2,1-2H3,(H,16,18).
What are the key properties of N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide?
N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide has a molecular weight of 278.35 g/mol, XLogP of 2.37, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-hydroxycyclohexyl)amino]-2-methoxyphenyl]acetamide is sourced from PubChem (CID 106593678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).