1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

C15H23ClN2O2 — CID 119288741

IUPAC1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCOCc1cccc(NC(=O)C2(N)CCCCC2)c1.Cl
InChIInChI=1S/C15H22N2O2.ClH/c1-19-11-12-6-5-7-13(10-12)17-14(18)15(16)8-3-2-4-9-15;/h5-7,10H,2-4,8-9,11,16H2,1H3,(H,17,18);1H
InChIKeyOZFOHTMGVQEOLI-UHFFFAOYSA-N
MW298.81 g/mol
LogP2.85
Rot. Bonds4

About 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119288741) has the molecular formula C15H23ClN2O2 and a molecular weight of 298.81 g/mol. Its IUPAC name is 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119288741
Molecular FormulaC15H23ClN2O2
Molecular Weight298.81 g/mol
Exact Mass298.14
IUPAC Name1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCOCc1cccc(NC(=O)C2(N)CCCCC2)c1.Cl
InChIInChI=1S/C15H22N2O2.ClH/c1-19-11-12-6-5-7-13(10-12)17-14(18)15(16)8-3-2-4-9-15;/h5-7,10H,2-4,8-9,11,16H2,1H3,(H,17,18);1H
InChIKeyOZFOHTMGVQEOLI-UHFFFAOYSA-N
XLogP2.85
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.81
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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1-amino-N-(3-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
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1-(N'-hydroxycarbamimidoyl)-N-[3-(methoxymethyl)phenyl]cyclopentane-1-carboxamide
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1-amino-N-[3-(sulfamoylmethyl)phenyl]cyclohexane-1-carboxamide
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2-[1-(aminomethyl)cyclohexyl]-N-[3-(methoxymethyl)phenyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (CID 119288741) is 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is COCc1cccc(NC(=O)C2(N)CCCCC2)c1.Cl.
What is the InChIKey of 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is OZFOHTMGVQEOLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2.ClH/c1-19-11-12-6-5-7-13(10-12)17-14(18)15(16)8-3-2-4-9-15;/h5-7,10H,2-4,8-9,11,16H2,1H3,(H,17,18);1H.
What are the key properties of 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 298.81 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119288741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).