(3R)-N-benzhydrylhex-5-en-3-amine

C19H23N — CID 135041353

IUPAC(3R)-N-benzhydrylhex-5-en-3-amine
SMILESC=CC[C@@H](CC)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N/c1-3-11-18(4-2)20-19(16-12-7-5-8-13-16)17-14-9-6-10-15-17/h3,5-10,12-15,18-20H,1,4,11H2,2H3/t18-/m1/s1
InChIKeyYLRXACBQMUIFTE-GOSISDBHSA-N
MW265.40 g/mol
LogP4.72
Rot. Bonds7

About (3R)-N-benzhydrylhex-5-en-3-amine

(3R)-N-benzhydrylhex-5-en-3-amine (PubChem CID 135041353) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is (3R)-N-benzhydrylhex-5-en-3-amine.

Molecular Properties

Compound Name(3R)-N-benzhydrylhex-5-en-3-amine
PubChem CID135041353
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name(3R)-N-benzhydrylhex-5-en-3-amine
SMILESC=CC[C@@H](CC)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N/c1-3-11-18(4-2)20-19(16-12-7-5-8-13-16)17-14-9-6-10-15-17/h3,5-10,12-15,18-20H,1,4,11H2,2H3/t18-/m1/s1
InChIKeyYLRXACBQMUIFTE-GOSISDBHSA-N
XLogP4.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-benzhydryl-1-chloropropan-1-amine
CID 70410579
3-[(pentan-3-ylamino)-phenylmethyl]benzonitrile
CID 139791723
5-phenylhept-1-en-4-amine
CID 115814558
[(4S,5S)-5-phenylocta-1,7-dien-4-yl]benzene
CID 97429057
N-ethyl-1,1-diphenylpent-4-en-2-amine
CID 61380727
(2S)-2-phenyl-2-[[(4R)-tridec-1-en-4-yl]amino]ethanol
CID 101125400
3-[[furan-2-yl(phenyl)methyl]amino]pentan-1-ol
CID 104531232
N-[(1R)-1-phenylethyl]pentan-3-amine;hydrochloride
CID 22831493
N-(1-pyridin-4-ylbut-3-enyl)pentan-3-amine
CID 115720314
oct-1-en-4-ylbenzene
CID 22247233
1-phenylbut-3-enylhydrazine
CID 105199312
4,6-diphenylnona-1,8-dien-5-one
CID 69419927

Frequently Asked Questions

What is the IUPAC name of (3R)-N-benzhydrylhex-5-en-3-amine?
The IUPAC name of (3R)-N-benzhydrylhex-5-en-3-amine (CID 135041353) is (3R)-N-benzhydrylhex-5-en-3-amine.
What is the SMILES notation for (3R)-N-benzhydrylhex-5-en-3-amine?
The canonical SMILES for (3R)-N-benzhydrylhex-5-en-3-amine is C=CC[C@@H](CC)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of (3R)-N-benzhydrylhex-5-en-3-amine?
The InChIKey is YLRXACBQMUIFTE-GOSISDBHSA-N. The full InChI is InChI=1S/C19H23N/c1-3-11-18(4-2)20-19(16-12-7-5-8-13-16)17-14-9-6-10-15-17/h3,5-10,12-15,18-20H,1,4,11H2,2H3/t18-/m1/s1.
What are the key properties of (3R)-N-benzhydrylhex-5-en-3-amine?
(3R)-N-benzhydrylhex-5-en-3-amine has a molecular weight of 265.40 g/mol, XLogP of 4.72, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-benzhydrylhex-5-en-3-amine is sourced from PubChem (CID 135041353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).