N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine

C19H26N2 — CID 43079199

IUPACN-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine
SMILESCN(C1CCCCC1)C(CN)c1cccc2ccccc12
InChIInChI=1S/C19H26N2/c1-21(16-10-3-2-4-11-16)19(14-20)18-13-7-9-15-8-5-6-12-17(15)18/h5-9,12-13,16,19H,2-4,10-11,14,20H2,1H3
InChIKeyAYHNVAUTVIPQCP-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.10
Rot. Bonds4

About N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine

N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine (PubChem CID 43079199) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine
PubChem CID43079199
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine
SMILESCN(C1CCCCC1)C(CN)c1cccc2ccccc12
InChIInChI=1S/C19H26N2/c1-21(16-10-3-2-4-11-16)19(14-20)18-13-7-9-15-8-5-6-12-17(15)18/h5-9,12-13,16,19H,2-4,10-11,14,20H2,1H3
InChIKeyAYHNVAUTVIPQCP-UHFFFAOYSA-N
XLogP4.10
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-N-cyclohexyl-N-methylethane-1,2-diamine
CID 43180386
N-cycloheptyl-1-(2-ethylphenyl)-N-methylethane-1,2-diamine
CID 62413896
N-cyclohexyl-1-(2-cyclopropylphenyl)-N-methylethane-1,2-diamine
CID 79983610
N-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 43266992
N-cyclohexyl-N-methyl-1-(3-methylphenyl)ethane-1,2-diamine
CID 16783142
1-(1-benzothiophen-3-yl)-N-cyclopropyl-N-methylethane-1,2-diamine
CID 62698680
1-(3-chlorophenyl)-N-cycloheptyl-N-methylethane-1,2-diamine
CID 43613871
N-cycloheptyl-1-(2,4-difluorophenyl)-N-methylethane-1,2-diamine
CID 43613899
N-cyclopropyl-1-(2-ethoxyphenyl)-N-methylethane-1,2-diamine
CID 43264757
2-[1-[cyclohexyl(methyl)amino]propyl]phenol
CID 82974252
(1R,2R)-3-amino-1-cyclohexyl-2-naphthalen-1-ylpropan-1-ol
CID 69271499
1-(4-chlorophenyl)-N-cyclopentyl-N-methylethane-1,2-diamine
CID 43267005

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The IUPAC name of N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine (CID 43079199) is N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine.
What is the SMILES notation for N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The canonical SMILES for N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine is CN(C1CCCCC1)C(CN)c1cccc2ccccc12.
What is the InChIKey of N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The InChIKey is AYHNVAUTVIPQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-21(16-10-3-2-4-11-16)19(14-20)18-13-7-9-15-8-5-6-12-17(15)18/h5-9,12-13,16,19H,2-4,10-11,14,20H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine has a molecular weight of 282.43 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-1-naphthalen-1-ylethane-1,2-diamine is sourced from PubChem (CID 43079199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).