(1S)-1-(4-methylphenyl)propan-1-amine

C10H15N — CID 7028357

IUPAC(1S)-1-(4-methylphenyl)propan-1-amine
SMILESCC[C@H](N)c1ccc(C)cc1
InChIInChI=1S/C10H15N/c1-3-10(11)9-6-4-8(2)5-7-9/h4-7,10H,3,11H2,1-2H3/t10-/m0/s1
InChIKeyFWTZOQCAVLMPJE-JTQLQIEISA-N
MW149.24 g/mol
LogP2.40
Rot. Bonds2

About (1S)-1-(4-methylphenyl)propan-1-amine

(1S)-1-(4-methylphenyl)propan-1-amine (PubChem CID 7028357) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is (1S)-1-(4-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name(1S)-1-(4-methylphenyl)propan-1-amine
PubChem CID7028357
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name(1S)-1-(4-methylphenyl)propan-1-amine
SMILESCC[C@H](N)c1ccc(C)cc1
InChIInChI=1S/C10H15N/c1-3-10(11)9-6-4-8(2)5-7-9/h4-7,10H,3,11H2,1-2H3/t10-/m0/s1
InChIKeyFWTZOQCAVLMPJE-JTQLQIEISA-N
XLogP2.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;1-(4-methylphenyl)propan-1-amine
CID 142982263
3-ethoxy-1-(4-methylphenyl)propan-1-amine
CID 115601658
1-[4-(3-fluoro-5-methylphenyl)phenyl]propan-1-amine
CID 79691066
(1R)-N'-ethoxy-1-(4-methylphenyl)ethane-1,2-diamine
CID 163787468
2-ethylsulfonyl-1-(4-methylphenyl)ethanamine
CID 64646967
(1S)-1-phenylpropan-1-amine;hydrochloride
CID 44542268
(3R)-3-amino-3-(4-methylphenyl)propane-1,1-diol
CID 163794645
(1S)-3,3-difluoro-1-(4-methylphenyl)propan-1-amine
CID 131389625
1-[4-(1-aminopropyl)phenyl]propane-1-thiol;ethane
CID 169145239
(1S)-1-pyridin-4-ylpropan-1-amine
CID 26722519
N',N'-diethyl-1-(4-methylphenyl)propane-1,3-diamine
CID 62619570
1-[4-[4-(trifluoromethyl)phenyl]phenyl]propan-1-amine
CID 61032956

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(4-methylphenyl)propan-1-amine?
The IUPAC name of (1S)-1-(4-methylphenyl)propan-1-amine (CID 7028357) is (1S)-1-(4-methylphenyl)propan-1-amine.
What is the SMILES notation for (1S)-1-(4-methylphenyl)propan-1-amine?
The canonical SMILES for (1S)-1-(4-methylphenyl)propan-1-amine is CC[C@H](N)c1ccc(C)cc1.
What is the InChIKey of (1S)-1-(4-methylphenyl)propan-1-amine?
The InChIKey is FWTZOQCAVLMPJE-JTQLQIEISA-N. The full InChI is InChI=1S/C10H15N/c1-3-10(11)9-6-4-8(2)5-7-9/h4-7,10H,3,11H2,1-2H3/t10-/m0/s1.
What are the key properties of (1S)-1-(4-methylphenyl)propan-1-amine?
(1S)-1-(4-methylphenyl)propan-1-amine has a molecular weight of 149.24 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(4-methylphenyl)propan-1-amine is sourced from PubChem (CID 7028357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).