N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide

C20H26N2O — CID 110279247

IUPACN-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide
SMILESCN(C)CC1CCCCC1NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H26N2O/c1-22(2)14-18-9-5-6-10-19(18)21-20(23)17-12-11-15-7-3-4-8-16(15)13-17/h3-4,7-8,11-13,18-19H,5-6,9-10,14H2,1-2H3,(H,21,23)
InChIKeyZSVDPLWRAPOWRE-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.69
Rot. Bonds4

About N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide

N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide (PubChem CID 110279247) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide
PubChem CID110279247
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC NameN-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide
SMILESCN(C)CC1CCCCC1NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H26N2O/c1-22(2)14-18-9-5-6-10-19(18)21-20(23)17-12-11-15-7-3-4-8-16(15)13-17/h3-4,7-8,11-13,18-19H,5-6,9-10,14H2,1-2H3,(H,21,23)
InChIKeyZSVDPLWRAPOWRE-UHFFFAOYSA-N
XLogP3.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(dimethylamino)methyl]cyclohexyl]-4-methoxybenzamide
CID 110279273
N-[2-[(dimethylamino)methyl]cyclohexyl]-3-methoxybenzamide
CID 110279269
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
CID 110279233
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-(tetrazol-1-yl)benzamide
CID 110279154
2-chloro-N-[2-[(dimethylamino)methyl]cyclohexyl]-6-fluorobenzamide
CID 110279243
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)naphthalene-2-carboxamide
CID 75414949
N-[2-(bromomethyl)cyclohexyl]-3-hydroxybenzamide
CID 106367295
N-[2-(bromomethyl)cyclohexyl]-4-(dimethylamino)benzamide
CID 106367084
N-[2-[(dimethylamino)methyl]cyclohexyl]-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 110279135
2-chloro-N-[2-(hydroxymethyl)cyclohexyl]quinoline-6-carboxamide
CID 110011733
3-bromo-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103798593

Frequently Asked Questions

What is the IUPAC name of N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide (CID 110279247) is N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide is CN(C)CC1CCCCC1NC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide?
The InChIKey is ZSVDPLWRAPOWRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-22(2)14-18-9-5-6-10-19(18)21-20(23)17-12-11-15-7-3-4-8-16(15)13-17/h3-4,7-8,11-13,18-19H,5-6,9-10,14H2,1-2H3,(H,21,23).
What are the key properties of N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide?
N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide has a molecular weight of 310.44 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(dimethylamino)methyl]cyclohexyl]naphthalene-2-carboxamide is sourced from PubChem (CID 110279247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).