N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide

C15H22N2O2 — CID 106124287

IUPACN-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)NCC2CCC(N)CC2)c1
InChIInChI=1S/C15H22N2O2/c1-10-2-7-14(18)13(8-10)15(19)17-9-11-3-5-12(16)6-4-11/h2,7-8,11-12,18H,3-6,9,16H2,1H3,(H,17,19)
InChIKeyAPYMHCUHQFVZQZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.95
Rot. Bonds3

About N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide

N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide (PubChem CID 106124287) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide.

Molecular Properties

Compound NameN-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
PubChem CID106124287
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)NCC2CCC(N)CC2)c1
InChIInChI=1S/C15H22N2O2/c1-10-2-7-14(18)13(8-10)15(19)17-9-11-3-5-12(16)6-4-11/h2,7-8,11-12,18H,3-6,9,16H2,1H3,(H,17,19)
InChIKeyAPYMHCUHQFVZQZ-UHFFFAOYSA-N
XLogP1.95
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
CID 106123350
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methoxybenzamide
CID 106124081
2-hydroxy-N-[(3-hydroxycyclopentyl)methyl]-5-methylbenzamide
CID 103279879
N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide
CID 106121411
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-3-methylbenzamide
CID 106124188
N-[[(3S)-1-(1,3-dihydroxypropan-2-yl)pyrrolidin-3-yl]methyl]-2-hydroxy-5-methylbenzamide
CID 95230640
N-[(4-aminocyclohexyl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 106124578
N-(2-amino-2-cyclopropylethyl)-2-hydroxy-5-methylbenzamide
CID 55242936
N-[(4-aminocyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 106124207
2-amino-5-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63707297
N-[2-(cyclopropylamino)-2-oxoethyl]-2-hydroxy-5-methylbenzamide
CID 43420144
N-(4-aminocyclohexyl)-2-hydroxy-5-methyl-N-propylbenzamide
CID 79116898

Frequently Asked Questions

What is the IUPAC name of N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide?
The IUPAC name of N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide (CID 106124287) is N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide.
What is the SMILES notation for N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide?
The canonical SMILES for N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide is Cc1ccc(O)c(C(=O)NCC2CCC(N)CC2)c1.
What is the InChIKey of N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide?
The InChIKey is APYMHCUHQFVZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-2-7-14(18)13(8-10)15(19)17-9-11-3-5-12(16)6-4-11/h2,7-8,11-12,18H,3-6,9,16H2,1H3,(H,17,19).
What are the key properties of N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide?
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 1.95, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide is sourced from PubChem (CID 106124287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).