4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol

C19H25NO — CID 68673415

IUPAC4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol
SMILESCN(C)CC1(c2ccc3ccccc3c2)CCC(O)CC1
InChIInChI=1S/C19H25NO/c1-20(2)14-19(11-9-18(21)10-12-19)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13,18,21H,9-12,14H2,1-2H3
InChIKeyYVYRBWXITIPQTA-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.57
Rot. Bonds3

About 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol

4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol (PubChem CID 68673415) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol
PubChem CID68673415
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol
SMILESCN(C)CC1(c2ccc3ccccc3c2)CCC(O)CC1
InChIInChI=1S/C19H25NO/c1-20(2)14-19(11-9-18(21)10-12-19)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13,18,21H,9-12,14H2,1-2H3
InChIKeyYVYRBWXITIPQTA-UHFFFAOYSA-N
XLogP3.57
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-Naphthyl)-3-(4-phenyl-1-piperidyl)propan-2-ol
CID 369971
(1R,2S)-1-cyclohexyl-3-(dimethylamino)-2-naphthalen-2-ylpropan-1-ol
CID 11630988
4-[(Dimethylamino)methyl]-1-methyl-4-naphthalen-2-ylcyclohexan-1-ol
CID 58954900
1-Methyl-4-(methylaminomethyl)-4-naphthalen-2-ylcyclohexan-1-ol
CID 68673872
SN 1796
CID 213804
1'-(2-phenylethyl)spiro[3,4-dihydro-2H-naphthalene-1,4'-piperidine]-2-ol
CID 44347788
(2R,3R)-1-(dimethylamino)-4,4-dimethyl-2-naphthalen-2-ylpentan-3-ol;hydrochloride
CID 45262357
(1R,2R)-3-(dimethylamino)-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride
CID 45265245
(4aS,5S,6S,8aS)-2-[3-(4-tert-butylphenyl)-2-methylpropyl]-5,8a-dimethyl-1,3,4,4a,5,6,7,8-octahydroisoquinolin-6-ol
CID 76315516
4-(Aminomethyl)-1-(fluoromethyl)-4-naphthalen-2-ylcyclohexan-1-ol
CID 68674871
1-(Fluoromethyl)-4-(methylaminomethyl)-4-naphthalen-2-ylcyclohexan-1-ol
CID 68674881
4-[(Dimethylamino)methyl]-1-(fluoromethyl)-4-naphthalen-2-ylcyclohexan-1-ol
CID 68674974

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol?
The IUPAC name of 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol (CID 68673415) is 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol.
What is the SMILES notation for 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol?
The canonical SMILES for 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol is CN(C)CC1(c2ccc3ccccc3c2)CCC(O)CC1.
What is the InChIKey of 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol?
The InChIKey is YVYRBWXITIPQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-20(2)14-19(11-9-18(21)10-12-19)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13,18,21H,9-12,14H2,1-2H3.
What are the key properties of 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol?
4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol has a molecular weight of 283.42 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-4-naphthalen-2-ylcyclohexan-1-ol is sourced from PubChem (CID 68673415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).