(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine

C18H24NP — CID 10731871

IUPAC(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine
SMILESCC(C)(C)[C@H](N)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24NP/c1-18(2,3)17(19)14-20(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,14,19H2,1-3H3/t17-/m1/s1
InChIKeySGBNMEAXYLJQRV-QGZVFWFLSA-N
MW285.37 g/mol
LogP3.49
Rot. Bonds4

About (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine

(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine (PubChem CID 10731871) has the molecular formula C18H24NP and a molecular weight of 285.37 g/mol. Its IUPAC name is (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine.

Molecular Properties

Compound Name(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine
PubChem CID10731871
Molecular FormulaC18H24NP
Molecular Weight285.37 g/mol
Exact Mass285.16
IUPAC Name(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine
SMILESCC(C)(C)[C@H](N)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24NP/c1-18(2,3)17(19)14-20(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,14,19H2,1-3H3/t17-/m1/s1
InChIKeySGBNMEAXYLJQRV-QGZVFWFLSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(2S)-1-diphenylphosphanyl-3-methylbutan-2-amine
CID 15145880
2-diphenylphosphanyl-1-trimethylsilylethanamine
CID 174337828
[(2R)-1-diphenylphosphanylpropan-2-yl]-diphenylphosphane
CID 2724539
(3-diphenylphosphanyl-2,2-dimethylpropyl)-diphenylphosphane;methane
CID 159058846
(2S)-1-diphenylphosphanyl-3-methyl-N-propan-2-ylbutan-2-amine
CID 101430602
2,2-dimethylpropyl(diphenyl)phosphane;formaldehyde;rhodium
CID 88689211
2-methoxypropyl(diphenyl)phosphane
CID 23413688
[(2S)-2-methoxypropyl]-diphenylphosphane
CID 10658854
(2S)-3-diphenylphosphanyl-2-methylpropan-1-ol
CID 101090022
[2,2-bis(diphenylphosphanylmethyl)-3,3-dimethylbutyl]-diphenylphosphane
CID 59318614
N'-(1-diphenylphosphanyl-3-methylbutan-2-yl)-N,N-dimethylmethanimidamide
CID 23420494
1-diphenylphosphanylpentan-2-yl(diphenyl)phosphane
CID 20520952

Frequently Asked Questions

What is the IUPAC name of (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine?
The IUPAC name of (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine (CID 10731871) is (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine.
What is the SMILES notation for (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine?
The canonical SMILES for (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine is CC(C)(C)[C@H](N)CP(c1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine?
The InChIKey is SGBNMEAXYLJQRV-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H24NP/c1-18(2,3)17(19)14-20(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,14,19H2,1-3H3/t17-/m1/s1.
What are the key properties of (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine?
(2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine has a molecular weight of 285.37 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-diphenylphosphanyl-3,3-dimethylbutan-2-amine is sourced from PubChem (CID 10731871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).