2,3-dimethyl-3-phenylbutan-2-amine

C12H19N — CID 54449592

IUPAC2,3-dimethyl-3-phenylbutan-2-amine
SMILESCC(C)(N)C(C)(C)c1ccccc1
InChIInChI=1S/C12H19N/c1-11(2,12(3,4)13)10-8-6-5-7-9-10/h5-9H,13H2,1-4H3
InChIKeyCJFLODAZNDASQY-UHFFFAOYSA-N
MW177.29 g/mol
LogP2.70
Rot. Bonds2

About 2,3-dimethyl-3-phenylbutan-2-amine

2,3-dimethyl-3-phenylbutan-2-amine (PubChem CID 54449592) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 2,3-dimethyl-3-phenylbutan-2-amine.

Molecular Properties

Compound Name2,3-dimethyl-3-phenylbutan-2-amine
PubChem CID54449592
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name2,3-dimethyl-3-phenylbutan-2-amine
SMILESCC(C)(N)C(C)(C)c1ccccc1
InChIInChI=1S/C12H19N/c1-11(2,12(3,4)13)10-8-6-5-7-9-10/h5-9H,13H2,1-4H3
InChIKeyCJFLODAZNDASQY-UHFFFAOYSA-N
XLogP2.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,1-diphenylethanamine
CID 12761172
hydrogen peroxide;2,3,3-trimethylbutan-2-ylbenzene
CID 23026515
(1R)-1-iodo-1-phenylethanamine
CID 68727841
2,3,3,4,4-pentamethylpentan-2-ylbenzene
CID 59630443
3-methyl-2,2-diphenylbutane-1,3-diamine
CID 67265829
(1,1-difluoro-2-methyl-1-phenylpropan-2-yl)benzene
CID 167184164
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
2-(2-phenylpropan-2-ylperoxy)propan-2-ylbenzene
CID 174400461
1-N'-methyl-1-phenylethane-1,1-diamine
CID 143337584
tert-butylbenzene;molecular nitrogen
CID 146464751
(1-bromo-1-phenylethyl)benzene
CID 19019197

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-3-phenylbutan-2-amine?
The IUPAC name of 2,3-dimethyl-3-phenylbutan-2-amine (CID 54449592) is 2,3-dimethyl-3-phenylbutan-2-amine.
What is the SMILES notation for 2,3-dimethyl-3-phenylbutan-2-amine?
The canonical SMILES for 2,3-dimethyl-3-phenylbutan-2-amine is CC(C)(N)C(C)(C)c1ccccc1.
What is the InChIKey of 2,3-dimethyl-3-phenylbutan-2-amine?
The InChIKey is CJFLODAZNDASQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-11(2,12(3,4)13)10-8-6-5-7-9-10/h5-9H,13H2,1-4H3.
What are the key properties of 2,3-dimethyl-3-phenylbutan-2-amine?
2,3-dimethyl-3-phenylbutan-2-amine has a molecular weight of 177.29 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-3-phenylbutan-2-amine is sourced from PubChem (CID 54449592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).