2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol

C12H19NO — CID 54776090

IUPAC2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol
SMILESCNC(CO)c1ccc(C(C)C)cc1
InChIInChI=1S/C12H19NO/c1-9(2)10-4-6-11(7-5-10)12(8-14)13-3/h4-7,9,12-14H,8H2,1-3H3
InChIKeyJZNUQDPZYLWKMF-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.06
Rot. Bonds4

About 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol

2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol (PubChem CID 54776090) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol
PubChem CID54776090
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol
SMILESCNC(CO)c1ccc(C(C)C)cc1
InChIInChI=1S/C12H19NO/c1-9(2)10-4-6-11(7-5-10)12(8-14)13-3/h4-7,9,12-14H,8H2,1-3H3
InChIKeyJZNUQDPZYLWKMF-UHFFFAOYSA-N
XLogP2.06
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-cyclopropylphenyl)-2-(methylamino)ethanol
CID 79980509
(2R)-2-(3,4-dimethylphenyl)-2-(methylamino)ethanol
CID 93471271
(2S)-2-(methylamino)-2-(4-nitrophenyl)ethanol
CID 55276773
(2R)-2-(4-bromo-3-chlorophenyl)-2-(methylamino)ethanol
CID 130740818
2-(3-bromo-4-chlorophenyl)-2-(methylamino)ethanol
CID 115563179
N-(2-hydroxy-1-phenylethyl)-4-propan-2-ylbenzenesulfonamide
CID 4204448
2-[2-(diethylamino)ethylamino]-2-(4-propan-2-ylphenyl)ethanol
CID 61049233
methylamino-(4-propan-2-ylphenyl)methanol
CID 116954610
N,3,3-trimethyl-1-(4-propan-2-ylphenyl)butane-1,4-diamine
CID 116950062
2-butan-2-ylsulfanyl-N-methyl-1-(4-propan-2-ylphenyl)ethanamine
CID 64613834
5-[(1S)-2-hydroxy-1-(methylamino)ethyl]benzene-1,3-diol
CID 55276021
(2R)-2-(4-chlorophenyl)-2-(propan-2-ylamino)ethanol
CID 93470492

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol (CID 54776090) is 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol is CNC(CO)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol?
The InChIKey is JZNUQDPZYLWKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(2)10-4-6-11(7-5-10)12(8-14)13-3/h4-7,9,12-14H,8H2,1-3H3.
What are the key properties of 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol?
2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol has a molecular weight of 193.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-2-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 54776090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).