(1R)-1-(3,4-dimethylphenyl)ethanamine

C10H15N — CID 7022091

IUPAC(1R)-1-(3,4-dimethylphenyl)ethanamine
SMILESCc1ccc([C@@H](C)N)cc1C
InChIInChI=1S/C10H15N/c1-7-4-5-10(9(3)11)6-8(7)2/h4-6,9H,11H2,1-3H3/t9-/m1/s1
InChIKeyPMUVPGYHXWUERM-SECBINFHSA-N
MW149.24 g/mol
LogP2.32
Rot. Bonds1

About (1R)-1-(3,4-dimethylphenyl)ethanamine

(1R)-1-(3,4-dimethylphenyl)ethanamine (PubChem CID 7022091) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is (1R)-1-(3,4-dimethylphenyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(3,4-dimethylphenyl)ethanamine
PubChem CID7022091
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name(1R)-1-(3,4-dimethylphenyl)ethanamine
SMILESCc1ccc([C@@H](C)N)cc1C
InChIInChI=1S/C10H15N/c1-7-4-5-10(9(3)11)6-8(7)2/h4-6,9H,11H2,1-3H3/t9-/m1/s1
InChIKeyPMUVPGYHXWUERM-SECBINFHSA-N
XLogP2.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-(4-fluoro-3-methylphenyl)ethanamine
CID 45072346
1-(3-bromo-4-methylphenyl)ethanamine
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4-[(1R)-1-aminoethyl]-2-methylphenol
CID 59272894
1,2-dimethyl-4-propan-2-ylbenzene;ethane
CID 142019921
(1R)-1-(3,4-dimethylphenyl)-2,2-difluoroethanamine
CID 29069144
2-(3,4-dimethylphenyl)propan-1-amine
CID 43316823
(1R)-1-(3,4-dimethylphenyl)-2-methylbutan-1-amine
CID 131078048
4-(1-bromo-2-methylpropyl)-1,2-dimethylbenzene
CID 63436116
1-(3,4-dimethylphenyl)-2-propan-2-yloxyethanamine
CID 43184504
(3,4-dimethylphenyl)-(3,5-dimethylphenyl)methanamine
CID 43149143
1-[3-chloro-4-(3,4-dimethylphenoxy)phenyl]ethanamine
CID 55132671
(1R)-1-[3-chloro-4-(3,4-dimethylphenoxy)phenyl]ethanamine
CID 63369799

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3,4-dimethylphenyl)ethanamine?
The IUPAC name of (1R)-1-(3,4-dimethylphenyl)ethanamine (CID 7022091) is (1R)-1-(3,4-dimethylphenyl)ethanamine.
What is the SMILES notation for (1R)-1-(3,4-dimethylphenyl)ethanamine?
The canonical SMILES for (1R)-1-(3,4-dimethylphenyl)ethanamine is Cc1ccc([C@@H](C)N)cc1C.
What is the InChIKey of (1R)-1-(3,4-dimethylphenyl)ethanamine?
The InChIKey is PMUVPGYHXWUERM-SECBINFHSA-N. The full InChI is InChI=1S/C10H15N/c1-7-4-5-10(9(3)11)6-8(7)2/h4-6,9H,11H2,1-3H3/t9-/m1/s1.
What are the key properties of (1R)-1-(3,4-dimethylphenyl)ethanamine?
(1R)-1-(3,4-dimethylphenyl)ethanamine has a molecular weight of 149.24 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3,4-dimethylphenyl)ethanamine is sourced from PubChem (CID 7022091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).