5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol

C17H23NO — CID 70057285

IUPAC5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
SMILESCN(C)CCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C17H23NO/c1-18(2)12-6-10-16(19)13-15-9-5-8-14-7-3-4-11-17(14)15/h3-5,7-9,11,16,19H,6,10,12-13H2,1-2H3
InChIKeyQQUSWAISVXNVQN-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.09
Rot. Bonds6

About 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol

5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol (PubChem CID 70057285) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol.

Molecular Properties

Compound Name5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
PubChem CID70057285
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
SMILESCN(C)CCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C17H23NO/c1-18(2)12-6-10-16(19)13-15-9-5-8-14-7-3-4-11-17(14)15/h3-5,7-9,11,16,19H,6,10,12-13H2,1-2H3
InChIKeyQQUSWAISVXNVQN-UHFFFAOYSA-N
XLogP3.09
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 105122822
1-(dimethylamino)-3-naphthalen-1-ylpropan-2-ol
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1-naphthalen-1-ylnonan-2-ol
CID 19902465
4-(diethylamino)-1-naphthalen-1-ylbutan-2-ol
CID 79086780
5,5-dimethyl-1-naphthalen-1-ylhexan-2-ol
CID 105091563
N,N-dimethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059419
4-(dimethylamino)-1-(2-methylphenyl)butan-2-ol
CID 115345853
3-[(2S)-5-(dimethylamino)-2-hydroxypentyl]phenol
CID 163507834
N-[2-(dimethylamino)ethyl]-2-methyl-3-naphthalen-1-ylpropanamide
CID 18917772
2-methyl-3-naphthalen-1-ylpropane-1,1-diol
CID 20647931
1-(1-benzothiophen-3-yl)-4-(dimethylamino)butan-2-ol
CID 113291149
1-chloro-2-naphthalen-1-ylethanol
CID 54087449

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol?
The IUPAC name of 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol (CID 70057285) is 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol.
What is the SMILES notation for 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol?
The canonical SMILES for 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol is CN(C)CCCC(O)Cc1cccc2ccccc12.
What is the InChIKey of 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol?
The InChIKey is QQUSWAISVXNVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-18(2)12-6-10-16(19)13-15-9-5-8-14-7-3-4-11-17(14)15/h3-5,7-9,11,16,19H,6,10,12-13H2,1-2H3.
What are the key properties of 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol?
5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol has a molecular weight of 257.38 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol is sourced from PubChem (CID 70057285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).