1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol

C14H21NO — CID 117313193

IUPAC1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol
SMILESCN(C)CCc1ccc(CC2(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-15(2)10-7-12-3-5-13(6-4-12)11-14(16)8-9-14/h3-6,16H,7-11H2,1-2H3
InChIKeyYTTILQHQUHOKKQ-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.86
Rot. Bonds5

About 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol

1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol (PubChem CID 117313193) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol
PubChem CID117313193
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol
SMILESCN(C)CCc1ccc(CC2(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-15(2)10-7-12-3-5-13(6-4-12)11-14(16)8-9-14/h3-6,16H,7-11H2,1-2H3
InChIKeyYTTILQHQUHOKKQ-UHFFFAOYSA-N
XLogP1.86
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(Phenyl)-2-dimethylaminoethyl]cyclohexanol
CID 13520306
1-[1-(4-Trifluoromethylphenyl)-2-dimethylaminoethyl]cyclohexanol
CID 13520319
1-(2-Dimethylamino-1-p-tolyl-ethyl)-cyclohexanol (HCl)
CID 14739944
1,2,5-Trimethyl-4-(4-methylbenzyl)-4-piperidinol
CID 550781
1-[2-Dimethylamino-1-(4-trifluoromethyl-phenyl)-ethyl]-cyclopentanol (HCl)
CID 14739946
1-[2-Dimethylamino-1-(4-trifluoromethyl-phenyl)-ethyl]-cycloheptanol (HCl)
CID 14739948
6-(Dimethylamino)-2,3-dimethyl-2-phenylhexan-3-ol;hydrochloride
CID 15945630
4-(4-Ethylbenzyl)-1,2,5-trimethylpiperidin-4-ol
CID 3579174
Benzeneethanol, alpha-((dimethylamino)methyl)-
CID 3054344
1-(Dimethylamino)-2-phenylbutan-2-ol
CID 20561659
3-Methyl-6-dimethylamino-1,2-diphenylhexan-3-ol hydrochloride
CID 3028592
4-Benzyl-1,2,5-trimethylpiperidin-4-ol
CID 612649

Frequently Asked Questions

What is the IUPAC name of 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol (CID 117313193) is 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol is CN(C)CCc1ccc(CC2(O)CC2)cc1.
What is the InChIKey of 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol?
The InChIKey is YTTILQHQUHOKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-15(2)10-7-12-3-5-13(6-4-12)11-14(16)8-9-14/h3-6,16H,7-11H2,1-2H3.
What are the key properties of 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol?
1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol is sourced from PubChem (CID 117313193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).