(1R)-1-(4-phenylphenyl)propane-1,3-diamine

C15H18N2 — CID 171208417

IUPAC(1R)-1-(4-phenylphenyl)propane-1,3-diamine
SMILESNCC[C@@H](N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H18N2/c16-11-10-15(17)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15H,10-11,16-17H2/t15-/m1/s1
InChIKeyQZWZVXLGSAWIJR-OAHLLOKOSA-N
MW226.32 g/mol
LogP2.70
Rot. Bonds4

About (1R)-1-(4-phenylphenyl)propane-1,3-diamine

(1R)-1-(4-phenylphenyl)propane-1,3-diamine (PubChem CID 171208417) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is (1R)-1-(4-phenylphenyl)propane-1,3-diamine.

Molecular Properties

Compound Name(1R)-1-(4-phenylphenyl)propane-1,3-diamine
PubChem CID171208417
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name(1R)-1-(4-phenylphenyl)propane-1,3-diamine
SMILESNCC[C@@H](N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H18N2/c16-11-10-15(17)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15H,10-11,16-17H2/t15-/m1/s1
InChIKeyQZWZVXLGSAWIJR-OAHLLOKOSA-N
XLogP2.70
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(4-phenylphenyl)pentane-1,5-diamine
CID 171208421
(1R)-3-fluoro-1-(4-phenylphenyl)propan-1-amine;hydrochloride
CID 171208436
1-(4-phenylphenyl)butan-1-amine
CID 43197430
3-amino-3-(4-phenylphenyl)propan-1-ol;hydrochloride
CID 170874439
(1S)-4,4,4-trifluoro-1-(4-phenylphenyl)butan-1-amine
CID 171228019
6-amino-6-(4-phenylphenyl)hexanamide
CID 60862321
(1R)-1-(3-phenylphenyl)butane-1,4-diamine
CID 171214569
4-[(1S)-1,3-diaminopropyl]phenol
CID 130913331
2-phenyl-2-(4-phenylphenyl)ethanamine
CID 44719858
(1R)-1-(4-fluorophenyl)propane-1,3-diamine;hydrochloride
CID 171199114
(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride
CID 171208431
2-(2-methylpropylsulfanyl)-1-(4-phenylphenyl)ethanamine
CID 64609674

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-phenylphenyl)propane-1,3-diamine?
The IUPAC name of (1R)-1-(4-phenylphenyl)propane-1,3-diamine (CID 171208417) is (1R)-1-(4-phenylphenyl)propane-1,3-diamine.
What is the SMILES notation for (1R)-1-(4-phenylphenyl)propane-1,3-diamine?
The canonical SMILES for (1R)-1-(4-phenylphenyl)propane-1,3-diamine is NCC[C@@H](N)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (1R)-1-(4-phenylphenyl)propane-1,3-diamine?
The InChIKey is QZWZVXLGSAWIJR-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H18N2/c16-11-10-15(17)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15H,10-11,16-17H2/t15-/m1/s1.
What are the key properties of (1R)-1-(4-phenylphenyl)propane-1,3-diamine?
(1R)-1-(4-phenylphenyl)propane-1,3-diamine has a molecular weight of 226.32 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-phenylphenyl)propane-1,3-diamine is sourced from PubChem (CID 171208417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).