(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine

C12H19NO — CID 30049099

IUPAC(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine
SMILESCN[C@H](C)c1ccc(OC(C)C)cc1
InChIInChI=1S/C12H19NO/c1-9(2)14-12-7-5-11(6-8-12)10(3)13-4/h5-10,13H,1-4H3/t10-/m1/s1
InChIKeySEQTUWLCLCHWPI-SNVBAGLBSA-N
MW193.29 g/mol
LogP2.75
Rot. Bonds4

About (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine

(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine (PubChem CID 30049099) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine
PubChem CID30049099
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine
SMILESCN[C@H](C)c1ccc(OC(C)C)cc1
InChIInChI=1S/C12H19NO/c1-9(2)14-12-7-5-11(6-8-12)10(3)13-4/h5-10,13H,1-4H3/t10-/m1/s1
InChIKeySEQTUWLCLCHWPI-SNVBAGLBSA-N
XLogP2.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-(4-methoxyphenyl)-N-methylethanamine
CID 143114257
(1S)-N-methyl-1-(4-phenoxyphenyl)ethanamine
CID 67664030
2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine
CID 79616330
N,2-dimethyl-1-(4-propan-2-yloxyphenyl)butan-1-amine
CID 43485559
N-[1-(4-propan-2-yloxyphenyl)ethyl]methanesulfonamide
CID 47319168
2-[4-[1-(methylamino)ethyl]phenoxy]-N-propan-2-ylpropanamide
CID 43279209
N-(dicyclopropylmethyl)-1-(4-propan-2-yloxyphenyl)ethanamine
CID 43100411
2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethanol
CID 43151137
1-(difluoromethyl)-4-propan-2-yloxybenzene
CID 130057921
N-methyl-4-propan-2-yloxyaniline
CID 18002910
(1S)-1-(4-propan-2-yloxyphenyl)ethanamine
CID 7446792
1,1-difluoro-3-[1-(4-propan-2-yloxyphenyl)ethylamino]propan-2-ol
CID 103788003

Frequently Asked Questions

What is the IUPAC name of (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine?
The IUPAC name of (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine (CID 30049099) is (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine.
What is the SMILES notation for (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine?
The canonical SMILES for (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine is CN[C@H](C)c1ccc(OC(C)C)cc1.
What is the InChIKey of (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine?
The InChIKey is SEQTUWLCLCHWPI-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(2)14-12-7-5-11(6-8-12)10(3)13-4/h5-10,13H,1-4H3/t10-/m1/s1.
What are the key properties of (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine?
(1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methyl-1-(4-propan-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 30049099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).