2-methyl-2-(4-methylphenyl)propan-1-amine;propane

C14H25N — CID 143028408

IUPAC2-methyl-2-(4-methylphenyl)propan-1-amine;propane
SMILESCCC.Cc1ccc(C(C)(C)CN)cc1
InChIInChI=1S/C11H17N.C3H8/c1-9-4-6-10(7-5-9)11(2,3)8-12;1-3-2/h4-7H,8,12H2,1-3H3;3H2,1-2H3
InChIKeyLTXIYTSZBULCKU-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.65
Rot. Bonds2

About 2-methyl-2-(4-methylphenyl)propan-1-amine;propane

2-methyl-2-(4-methylphenyl)propan-1-amine;propane (PubChem CID 143028408) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2-methyl-2-(4-methylphenyl)propan-1-amine;propane.

Molecular Properties

Compound Name2-methyl-2-(4-methylphenyl)propan-1-amine;propane
PubChem CID143028408
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2-methyl-2-(4-methylphenyl)propan-1-amine;propane
SMILESCCC.Cc1ccc(C(C)(C)CN)cc1
InChIInChI=1S/C11H17N.C3H8/c1-9-4-6-10(7-5-9)11(2,3)8-12;1-3-2/h4-7H,8,12H2,1-3H3;3H2,1-2H3
InChIKeyLTXIYTSZBULCKU-UHFFFAOYSA-N
XLogP3.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride
CID 74889721
2-methyl-2-(4-phenylphenyl)propan-1-amine
CID 56687090
2-[4-(4-chlorophenyl)phenyl]-2-methylpropan-1-amine
CID 82090050
2,4-dimethyl-4-(4-methylphenyl)pentan-2-amine
CID 71251464
O-[2-methyl-2-(4-methylphenyl)propyl]hydroxylamine
CID 83683498
2-(4-butan-2-ylphenyl)-2-methylpropan-1-amine
CID 82077217
2-(4-ethylsulfonylphenyl)-2-methylpropan-1-amine
CID 82477614
butane;methane;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;propane
CID 159232750
2-[4-(3,5-difluorophenyl)phenyl]-2-methylpropan-1-amine
CID 82090474
2-methyl-2-(4-methylphenyl)propane-1-sulfonamide
CID 115036327
2-methyl-2-(3-methylphenyl)propan-1-amine
CID 47002400
(2S)-2-fluoro-2-(4-methylphenyl)butan-1-amine
CID 129375642

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(4-methylphenyl)propan-1-amine;propane?
The IUPAC name of 2-methyl-2-(4-methylphenyl)propan-1-amine;propane (CID 143028408) is 2-methyl-2-(4-methylphenyl)propan-1-amine;propane.
What is the SMILES notation for 2-methyl-2-(4-methylphenyl)propan-1-amine;propane?
The canonical SMILES for 2-methyl-2-(4-methylphenyl)propan-1-amine;propane is CCC.Cc1ccc(C(C)(C)CN)cc1.
What is the InChIKey of 2-methyl-2-(4-methylphenyl)propan-1-amine;propane?
The InChIKey is LTXIYTSZBULCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C3H8/c1-9-4-6-10(7-5-9)11(2,3)8-12;1-3-2/h4-7H,8,12H2,1-3H3;3H2,1-2H3.
What are the key properties of 2-methyl-2-(4-methylphenyl)propan-1-amine;propane?
2-methyl-2-(4-methylphenyl)propan-1-amine;propane has a molecular weight of 207.36 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(4-methylphenyl)propan-1-amine;propane is sourced from PubChem (CID 143028408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).