[1-(diethylamino)cyclopentyl]-phenylmethanol

C16H25NO — CID 79069863

IUPAC[1-(diethylamino)cyclopentyl]-phenylmethanol
SMILESCCN(CC)C1(C(O)c2ccccc2)CCCC1
InChIInChI=1S/C16H25NO/c1-3-17(4-2)16(12-8-9-13-16)15(18)14-10-6-5-7-11-14/h5-7,10-11,15,18H,3-4,8-9,12-13H2,1-2H3
InChIKeyHLKXHVZIXAVCPX-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.37
Rot. Bonds5

About [1-(diethylamino)cyclopentyl]-phenylmethanol

[1-(diethylamino)cyclopentyl]-phenylmethanol (PubChem CID 79069863) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is [1-(diethylamino)cyclopentyl]-phenylmethanol.

Molecular Properties

Compound Name[1-(diethylamino)cyclopentyl]-phenylmethanol
PubChem CID79069863
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name[1-(diethylamino)cyclopentyl]-phenylmethanol
SMILESCCN(CC)C1(C(O)c2ccccc2)CCCC1
InChIInChI=1S/C16H25NO/c1-3-17(4-2)16(12-8-9-13-16)15(18)14-10-6-5-7-11-14/h5-7,10-11,15,18H,3-4,8-9,12-13H2,1-2H3
InChIKeyHLKXHVZIXAVCPX-UHFFFAOYSA-N
XLogP3.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(diethylamino)cyclopentyl]-(3,4-difluorophenyl)methanol
CID 79069796
[1-(diethylamino)cyclopentyl]-(5-methylthiophen-3-yl)methanol
CID 79070099
[1-(diethylamino)cyclopentyl]-(5-fluoro-3-pyridinyl)methanol
CID 79070018
1-[1-(diethylamino)cyclopentyl]ethanol
CID 79070716
1-[1-(diethylamino)cyclopentyl]-2-(4-ethylphenyl)ethanol
CID 79058910
1-[1-(diethylamino)cyclopentyl]-2-(4-methylphenyl)ethanol
CID 79070717
[1-(dimethylamino)cycloheptyl]-(4-methylphenyl)methanol
CID 79075014
(1-methoxycyclohexyl)-phenylmethanol
CID 116753267
1-[1-(dimethylamino)cyclopentyl]-2-phenylethanol
CID 79067226
(4-tert-butylphenyl)-[1-(dimethylamino)cyclopentyl]methanol
CID 79067862
1-[amino-(2-ethoxyphenyl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79059165
[1-(dimethylamino)cyclopentyl]-(2-ethoxyphenyl)methanol
CID 79067542

Frequently Asked Questions

What is the IUPAC name of [1-(diethylamino)cyclopentyl]-phenylmethanol?
The IUPAC name of [1-(diethylamino)cyclopentyl]-phenylmethanol (CID 79069863) is [1-(diethylamino)cyclopentyl]-phenylmethanol.
What is the SMILES notation for [1-(diethylamino)cyclopentyl]-phenylmethanol?
The canonical SMILES for [1-(diethylamino)cyclopentyl]-phenylmethanol is CCN(CC)C1(C(O)c2ccccc2)CCCC1.
What is the InChIKey of [1-(diethylamino)cyclopentyl]-phenylmethanol?
The InChIKey is HLKXHVZIXAVCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-17(4-2)16(12-8-9-13-16)15(18)14-10-6-5-7-11-14/h5-7,10-11,15,18H,3-4,8-9,12-13H2,1-2H3.
What are the key properties of [1-(diethylamino)cyclopentyl]-phenylmethanol?
[1-(diethylamino)cyclopentyl]-phenylmethanol has a molecular weight of 247.38 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(diethylamino)cyclopentyl]-phenylmethanol is sourced from PubChem (CID 79069863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).