2-(2-methylphenyl)-2-(propylamino)ethanol

C12H19NO — CID 61056185

IUPAC2-(2-methylphenyl)-2-(propylamino)ethanol
SMILESCCCNC(CO)c1ccccc1C
InChIInChI=1S/C12H19NO/c1-3-8-13-12(9-14)11-7-5-4-6-10(11)2/h4-7,12-14H,3,8-9H2,1-2H3
InChIKeyFGQGJZNMAGCPOT-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.03
Rot. Bonds5

About 2-(2-methylphenyl)-2-(propylamino)ethanol

2-(2-methylphenyl)-2-(propylamino)ethanol (PubChem CID 61056185) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(2-methylphenyl)-2-(propylamino)ethanol.

Molecular Properties

Compound Name2-(2-methylphenyl)-2-(propylamino)ethanol
PubChem CID61056185
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(2-methylphenyl)-2-(propylamino)ethanol
SMILESCCCNC(CO)c1ccccc1C
InChIInChI=1S/C12H19NO/c1-3-8-13-12(9-14)11-7-5-4-6-10(11)2/h4-7,12-14H,3,8-9H2,1-2H3
InChIKeyFGQGJZNMAGCPOT-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-(2-methylphenyl)-N-propylhexan-1-amine
CID 63413299
2-(2,3-dichlorophenyl)-2-(propylamino)ethanol
CID 61054379
N-[2-cyclopentyl-1-(2-methylphenyl)ethyl]propan-1-amine
CID 63413342
3-cyclopentyl-1-(2-methylphenyl)-N-propylpropan-1-amine
CID 115794758
N'-ethyl-1-(2-methylphenyl)-N,N'-dipropylpropane-1,3-diamine
CID 63483080
1-(2-methylphenyl)-N'-propan-2-yl-N,N'-dipropylethane-1,2-diamine
CID 63464856
N-[2-(3-ethoxycyclobutyl)-1-(2-methylphenyl)ethyl]propan-1-amine
CID 103168245
N-[2-butan-2-ylsulfinyl-1-(2-methylphenyl)ethyl]propan-1-amine
CID 64651076
N'-[2-(dimethylamino)ethyl]-N'-methyl-1-(2-methylphenyl)-N-propylpropane-1,3-diamine
CID 63698802
N-[2-hexoxy-1-(2-methylphenyl)ethyl]propan-1-amine
CID 63474742
N'-methyl-N'-(3-methylbutyl)-1-(2-methylphenyl)-N-propylpropane-1,3-diamine
CID 63493766
N-[1-(2-methylphenyl)-2-pyrimidin-2-ylsulfanylethyl]propan-1-amine
CID 64649429

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-2-(propylamino)ethanol?
The IUPAC name of 2-(2-methylphenyl)-2-(propylamino)ethanol (CID 61056185) is 2-(2-methylphenyl)-2-(propylamino)ethanol.
What is the SMILES notation for 2-(2-methylphenyl)-2-(propylamino)ethanol?
The canonical SMILES for 2-(2-methylphenyl)-2-(propylamino)ethanol is CCCNC(CO)c1ccccc1C.
What is the InChIKey of 2-(2-methylphenyl)-2-(propylamino)ethanol?
The InChIKey is FGQGJZNMAGCPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-8-13-12(9-14)11-7-5-4-6-10(11)2/h4-7,12-14H,3,8-9H2,1-2H3.
What are the key properties of 2-(2-methylphenyl)-2-(propylamino)ethanol?
2-(2-methylphenyl)-2-(propylamino)ethanol has a molecular weight of 193.29 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-2-(propylamino)ethanol is sourced from PubChem (CID 61056185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).