1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine

C19H26N2 — CID 43829798

IUPAC1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine
SMILESCCN(CC)CC(N)(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H26N2/c1-3-21(4-2)16-19(20,18-13-9-6-10-14-18)15-17-11-7-5-8-12-17/h5-14H,3-4,15-16,20H2,1-2H3
InChIKeyDZDBSEGTAHBPHO-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.43
Rot. Bonds7

About 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine

1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine (PubChem CID 43829798) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine
PubChem CID43829798
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine
SMILESCCN(CC)CC(N)(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H26N2/c1-3-21(4-2)16-19(20,18-13-9-6-10-14-18)15-17-11-7-5-8-12-17/h5-14H,3-4,15-16,20H2,1-2H3
InChIKeyDZDBSEGTAHBPHO-UHFFFAOYSA-N
XLogP3.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-diethyl-3-(4-methylphenyl)-2-phenylpropane-1,2-diamine
CID 43829802
1-N,1-N-diethyl-4-methyl-2-phenylpent-4-ene-1,2-diamine
CID 43829790
1-N-benzyl-1-N-ethyl-2,2,3-trimethylbutane-1,3-diamine
CID 65266664
1-N-benzyl-1-N-ethyl-2-methylpentane-1,2-diamine
CID 60852613
1-(4-iodophenyl)-2-phenylpentan-2-amine
CID 65476853
1,1,2-triphenylethanamine;hydrobromide
CID 175347021
2-amino-4-[ethyl(2,2,2-trifluoroethyl)amino]-2-phenylbutan-1-ol
CID 116695191
1-N-benzyl-1-N-ethyl-3-methoxy-2-methylpropane-1,2-diamine
CID 131049038
3-[benzyl(ethyl)amino]-2,2-difluoropropan-1-ol
CID 143474045
2-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 173297949
4-methyl-2-phenyl-1-N,1-N-dipropylpent-4-ene-1,2-diamine
CID 43829791
2-(2-fluorophenyl)-1-phenylbutan-2-amine
CID 79007656

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine?
The IUPAC name of 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine (CID 43829798) is 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine.
What is the SMILES notation for 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine?
The canonical SMILES for 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine is CCN(CC)CC(N)(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine?
The InChIKey is DZDBSEGTAHBPHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-3-21(4-2)16-19(20,18-13-9-6-10-14-18)15-17-11-7-5-8-12-17/h5-14H,3-4,15-16,20H2,1-2H3.
What are the key properties of 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine?
1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine has a molecular weight of 282.43 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-diethyl-2,3-diphenylpropane-1,2-diamine is sourced from PubChem (CID 43829798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).