1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol

C14H21NO — CID 63294182

IUPAC1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol
SMILESCc1ccc(C(C)NCC(O)C2CC2)cc1
InChIInChI=1S/C14H21NO/c1-10-3-5-12(6-4-10)11(2)15-9-14(16)13-7-8-13/h3-6,11,13-16H,7-9H2,1-2H3
InChIKeyXFLWEDQJPPVAQL-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.42
Rot. Bonds5

About 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol

1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol (PubChem CID 63294182) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol
PubChem CID63294182
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol
SMILESCc1ccc(C(C)NCC(O)C2CC2)cc1
InChIInChI=1S/C14H21NO/c1-10-3-5-12(6-4-10)11(2)15-9-14(16)13-7-8-13/h3-6,11,13-16H,7-9H2,1-2H3
InChIKeyXFLWEDQJPPVAQL-UHFFFAOYSA-N
XLogP2.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(4-butylphenyl)ethylamino]-1-cyclopropylethanol
CID 63294725
1-cyclopropyl-2-(1-thiophen-3-ylethylamino)ethanol
CID 63295027
4-[1-[(2-cyclopropyl-2-hydroxyethyl)amino]ethyl]-N,N-dimethylbenzenesulfonamide
CID 63298736
2-methyl-3-[1-(4-methylphenyl)ethylamino]propan-1-ol
CID 65034209
1-cyclopropyl-2-[1-(3,4,5-trimethoxyphenyl)ethylamino]ethanol
CID 63295210
1-cyclopropyl-2-[1-(2-methoxy-4-methylphenyl)ethylamino]ethanol
CID 55171592
5-[1-[(2-cyclopropyl-2-hydroxyethyl)amino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 55172165
1-cyclopropyl-2-[1-(3-methoxyphenyl)ethylamino]ethanol
CID 63294846
1-(4-methylphenyl)-N-(thian-4-ylmethyl)ethanamine
CID 115720001
3-hydroxy-4-[1-(4-methylphenyl)ethylamino]butanoic acid
CID 103246096
2-[1-(2-bromophenyl)ethylamino]-1-cyclopropylethanol
CID 63294580
2-[1-(1-benzofuran-2-yl)ethylamino]-1-cyclopropylethanol
CID 63295328

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol (CID 63294182) is 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol is Cc1ccc(C(C)NCC(O)C2CC2)cc1.
What is the InChIKey of 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol?
The InChIKey is XFLWEDQJPPVAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-3-5-12(6-4-10)11(2)15-9-14(16)13-7-8-13/h3-6,11,13-16H,7-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol?
1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol has a molecular weight of 219.33 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[1-(4-methylphenyl)ethylamino]ethanol is sourced from PubChem (CID 63294182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).