3,3-diphenyl-2-N-propylpropane-1,2-diamine

C18H24N2 — CID 107292802

IUPAC3,3-diphenyl-2-N-propylpropane-1,2-diamine
SMILESCCCNC(CN)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2/c1-2-13-20-17(14-19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18,20H,2,13-14,19H2,1H3
InChIKeyCAZCKLRIKDWXRK-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.15
Rot. Bonds7

About 3,3-diphenyl-2-N-propylpropane-1,2-diamine

3,3-diphenyl-2-N-propylpropane-1,2-diamine (PubChem CID 107292802) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3,3-diphenyl-2-N-propylpropane-1,2-diamine.

Molecular Properties

Compound Name3,3-diphenyl-2-N-propylpropane-1,2-diamine
PubChem CID107292802
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name3,3-diphenyl-2-N-propylpropane-1,2-diamine
SMILESCCCNC(CN)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2/c1-2-13-20-17(14-19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18,20H,2,13-14,19H2,1H3
InChIKeyCAZCKLRIKDWXRK-UHFFFAOYSA-N
XLogP3.15
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-diphenyl-N-propylpent-4-yn-2-amine
CID 62233521
3,3-diphenyl-2-N-prop-2-ynylpropane-1,2-diamine
CID 107292807
N-(1-phenylethyl)propan-1-amine;hydrochloride
CID 16641251
3-ethyl-2-N-(2-phenylethyl)pentane-1,2-diamine
CID 57365220
N-dodecyl-1-phenylethane-1,2-diamine
CID 146442827
3-phenyl-N-propylpentan-2-amine
CID 66438754
N-[(1S)-1,2-diphenylethyl]propan-1-amine
CID 36689865
(1S,2R)-1-phenyl-2-(propylamino)propan-1-ol
CID 14697423
N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine
CID 93032197
2-benzhydryl-3,3-diphenylpropan-1-amine
CID 139723407
7,7-dimethyl-3-phenyl-N-propyloctan-4-amine
CID 115849907
3-phenyl-3-(propylamino)propanamide
CID 65235689

Frequently Asked Questions

What is the IUPAC name of 3,3-diphenyl-2-N-propylpropane-1,2-diamine?
The IUPAC name of 3,3-diphenyl-2-N-propylpropane-1,2-diamine (CID 107292802) is 3,3-diphenyl-2-N-propylpropane-1,2-diamine.
What is the SMILES notation for 3,3-diphenyl-2-N-propylpropane-1,2-diamine?
The canonical SMILES for 3,3-diphenyl-2-N-propylpropane-1,2-diamine is CCCNC(CN)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 3,3-diphenyl-2-N-propylpropane-1,2-diamine?
The InChIKey is CAZCKLRIKDWXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-2-13-20-17(14-19)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-18,20H,2,13-14,19H2,1H3.
What are the key properties of 3,3-diphenyl-2-N-propylpropane-1,2-diamine?
3,3-diphenyl-2-N-propylpropane-1,2-diamine has a molecular weight of 268.40 g/mol, XLogP of 3.15, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-2-N-propylpropane-1,2-diamine is sourced from PubChem (CID 107292802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).