3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide

C17H20N2O — CID 63043411

IUPAC3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)Nc2ccc3ccccc3c2)C1
InChIInChI=1S/C17H20N2O/c18-15-7-3-6-14(10-15)17(20)19-16-9-8-12-4-1-2-5-13(12)11-16/h1-2,4-5,8-9,11,14-15H,3,6-7,10,18H2,(H,19,20)
InChIKeyXTABBKSHJRPTKL-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.30
Rot. Bonds2

About 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide

3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide (PubChem CID 63043411) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
PubChem CID63043411
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)Nc2ccc3ccccc3c2)C1
InChIInChI=1S/C17H20N2O/c18-15-7-3-6-14(10-15)17(20)19-16-9-8-12-4-1-2-5-13(12)11-16/h1-2,4-5,8-9,11,14-15H,3,6-7,10,18H2,(H,19,20)
InChIKeyXTABBKSHJRPTKL-UHFFFAOYSA-N
XLogP3.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexane-1-carboxamide
CID 119700137
3-amino-N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119700136
3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide
CID 119673239
N-[3-[(3-aminocyclohexanecarbonyl)amino]phenyl]benzamide;hydrochloride
CID 119709587
2-amino-N-naphthalen-2-ylcyclopropane-1-carboxamide
CID 55035485
3-amino-N-(4-bromo-3-methylphenyl)cyclohexane-1-carboxamide
CID 63042324
3-amino-N-(3,4-dicyanophenyl)cyclohexane-1-carboxamide
CID 107790584
3-amino-N-naphthalen-1-ylcyclohexane-1-carboxamide
CID 63042139
3-amino-N-(4-bromo-3-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119706250
3-amino-N-(3-cyanophenyl)cyclohexane-1-carboxamide
CID 63042853
3-amino-N-(4-cyclobutyloxy-3-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119811117
2-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 64823330

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide (CID 63043411) is 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide is NC1CCCC(C(=O)Nc2ccc3ccccc3c2)C1.
What is the InChIKey of 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide?
The InChIKey is XTABBKSHJRPTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c18-15-7-3-6-14(10-15)17(20)19-16-9-8-12-4-1-2-5-13(12)11-16/h1-2,4-5,8-9,11,14-15H,3,6-7,10,18H2,(H,19,20).
What are the key properties of 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide?
3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 3.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 63043411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).