2-N,2-N,2-triphenylbutane-2,3-diamine

C22H24N2 — CID 67601655

IUPAC2-N,2-N,2-triphenylbutane-2,3-diamine
SMILESCC(N)C(C)(c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24N2/c1-18(23)22(2,19-12-6-3-7-13-19)24(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18H,23H2,1-2H3
InChIKeyVTKMTWOBVBNLJQ-UHFFFAOYSA-N
MW316.45 g/mol
LogP5.09
Rot. Bonds5

About 2-N,2-N,2-triphenylbutane-2,3-diamine

2-N,2-N,2-triphenylbutane-2,3-diamine (PubChem CID 67601655) has the molecular formula C22H24N2 and a molecular weight of 316.45 g/mol. Its IUPAC name is 2-N,2-N,2-triphenylbutane-2,3-diamine.

Molecular Properties

Compound Name2-N,2-N,2-triphenylbutane-2,3-diamine
PubChem CID67601655
Molecular FormulaC22H24N2
Molecular Weight316.45 g/mol
Exact Mass316.19
IUPAC Name2-N,2-N,2-triphenylbutane-2,3-diamine
SMILESCC(N)C(C)(c1ccccc1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24N2/c1-18(23)22(2,19-12-6-3-7-13-19)24(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18H,23H2,1-2H3
InChIKeyVTKMTWOBVBNLJQ-UHFFFAOYSA-N
XLogP5.09
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.45
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 24841347
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(2S)-1,1-diphenylpropane-1,2-diamine
CID 11172185
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N,4-ditert-butyl-N-phenylaniline
CID 91172141
3-methyl-1,1,1-triphenylbutan-2-amine
CID 67050578
(2S)-3-ethyl-3-phenylpentan-2-amine
CID 64712581
1-(1,1-diphenylethoxy)ethanamine
CID 66761557
4-N-[4-(2-amino-3-methylpentan-3-yl)phenyl]-1-N-(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
CID 126703316
2-methyl-N-phenyl-N-(2-phenylpropan-2-yl)aniline
CID 130459887
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CID 143500343

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,2-triphenylbutane-2,3-diamine?
The IUPAC name of 2-N,2-N,2-triphenylbutane-2,3-diamine (CID 67601655) is 2-N,2-N,2-triphenylbutane-2,3-diamine.
What is the SMILES notation for 2-N,2-N,2-triphenylbutane-2,3-diamine?
The canonical SMILES for 2-N,2-N,2-triphenylbutane-2,3-diamine is CC(N)C(C)(c1ccccc1)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-N,2-N,2-triphenylbutane-2,3-diamine?
The InChIKey is VTKMTWOBVBNLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2/c1-18(23)22(2,19-12-6-3-7-13-19)24(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18H,23H2,1-2H3.
What are the key properties of 2-N,2-N,2-triphenylbutane-2,3-diamine?
2-N,2-N,2-triphenylbutane-2,3-diamine has a molecular weight of 316.45 g/mol, XLogP of 5.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,2-triphenylbutane-2,3-diamine is sourced from PubChem (CID 67601655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).