3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide

C15H23N3O — CID 63044143

IUPAC3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide
SMILESCN(C)c1ccccc1NC(=O)C1CCCC(N)C1
InChIInChI=1S/C15H23N3O/c1-18(2)14-9-4-3-8-13(14)17-15(19)11-6-5-7-12(16)10-11/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19)
InChIKeyGJLCYAPSURNJMU-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.21
Rot. Bonds3

About 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide

3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide (PubChem CID 63044143) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide
PubChem CID63044143
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide
SMILESCN(C)c1ccccc1NC(=O)C1CCCC(N)C1
InChIInChI=1S/C15H23N3O/c1-18(2)14-9-4-3-8-13(14)17-15(19)11-6-5-7-12(16)10-11/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19)
InChIKeyGJLCYAPSURNJMU-UHFFFAOYSA-N
XLogP2.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(dimethylamino)phenyl]cyclopentane-1-carboxamide
CID 66010603
3-amino-N-[2-(dimethylamino)-5-(dimethylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119689774
3-amino-N-naphthalen-1-ylcyclohexane-1-carboxamide
CID 63042139
3-amino-N-[2-(methanesulfonamido)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119704020
3-amino-N-(1-methyl-2-oxo-3-pyridinyl)cyclohexane-1-carboxamide
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3-amino-N-(3-chloro-2-methylphenyl)cyclohexane-1-carboxamide
CID 55146162
(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide
CID 81124791
3-amino-N-naphthalen-1-ylcyclohexane-1-carboxamide;hydrochloride
CID 119671192
3-amino-N-(2,3-dihydro-1,4-benzodioxin-5-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119740865
3-amino-N-[5-bromo-2-(dimethylamino)phenyl]cyclopentane-1-carboxamide
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CID 66007479

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide (CID 63044143) is 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide is CN(C)c1ccccc1NC(=O)C1CCCC(N)C1.
What is the InChIKey of 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide?
The InChIKey is GJLCYAPSURNJMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-18(2)14-9-4-3-8-13(14)17-15(19)11-6-5-7-12(16)10-11/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19).
What are the key properties of 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide?
3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 63044143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).