N,N-dibenzyl-3-phenylpropan-1-amine

C23H25N — CID 3867567

IUPACN,N-dibenzyl-3-phenylpropan-1-amine
SMILESc1ccc(CCCN(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C23H25N/c1-4-11-21(12-5-1)17-10-18-24(19-22-13-6-2-7-14-22)20-23-15-8-3-9-16-23/h1-9,11-16H,10,17-20H2
InChIKeyYDQBDYQCUOAAJM-UHFFFAOYSA-N
MW315.46 g/mol
LogP5.32
Rot. Bonds8

About N,N-dibenzyl-3-phenylpropan-1-amine

N,N-dibenzyl-3-phenylpropan-1-amine (PubChem CID 3867567) has the molecular formula C23H25N and a molecular weight of 315.46 g/mol. Its IUPAC name is N,N-dibenzyl-3-phenylpropan-1-amine.

Molecular Properties

Compound NameN,N-dibenzyl-3-phenylpropan-1-amine
PubChem CID3867567
Molecular FormulaC23H25N
Molecular Weight315.46 g/mol
Exact Mass315.20
IUPAC NameN,N-dibenzyl-3-phenylpropan-1-amine
SMILESc1ccc(CCCN(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C23H25N/c1-4-11-21(12-5-1)17-10-18-24(19-22-13-6-2-7-14-22)20-23-15-8-3-9-16-23/h1-9,11-16H,10,17-20H2
InChIKeyYDQBDYQCUOAAJM-UHFFFAOYSA-N
XLogP5.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.46
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N,N',N'-tetrabenzylpentane-1,5-diamine
CID 134925977
2-[benzyl(4-phenylbutyl)amino]ethanol
CID 114334509
N-[[4-[[bis(2-phenylethyl)amino]methyl]phenyl]methyl]-2-phenyl-N-(2-phenylethyl)ethanamine
CID 59482591
6-phenyl-N,N-bis(6-phenylhexyl)hexan-1-amine
CID 21451220
N,N-diethyl-3-phenylpropan-1-amine;hydrate
CID 172794416
N-[(2,5-difluorophenyl)methyl]-N-[(4-fluorophenyl)methyl]-3-phenylpropan-1-amine
CID 23965353
N-benzyl-3-bromo-N-(3-bromopropyl)propan-1-amine
CID 23242798
azane;N,N-diethyl-3-phenylpropan-1-amine;hydroiodide
CID 175520694
N,N-dibenzyldodecan-1-amine
CID 11508874
N-benzyl-N-[[3-[(dibenzylamino)methyl]phenyl]methyl]-2-phenylethanamine
CID 163873740
N-benzyl-N-[(4-chlorophenyl)methyl]-2-phenylethanamine
CID 4651725
N,N-dibenzyl-3-[3-(dibenzylamino)propylsulfonyl]propan-1-amine
CID 68796747

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-3-phenylpropan-1-amine?
The IUPAC name of N,N-dibenzyl-3-phenylpropan-1-amine (CID 3867567) is N,N-dibenzyl-3-phenylpropan-1-amine.
What is the SMILES notation for N,N-dibenzyl-3-phenylpropan-1-amine?
The canonical SMILES for N,N-dibenzyl-3-phenylpropan-1-amine is c1ccc(CCCN(Cc2ccccc2)Cc2ccccc2)cc1.
What is the InChIKey of N,N-dibenzyl-3-phenylpropan-1-amine?
The InChIKey is YDQBDYQCUOAAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N/c1-4-11-21(12-5-1)17-10-18-24(19-22-13-6-2-7-14-22)20-23-15-8-3-9-16-23/h1-9,11-16H,10,17-20H2.
What are the key properties of N,N-dibenzyl-3-phenylpropan-1-amine?
N,N-dibenzyl-3-phenylpropan-1-amine has a molecular weight of 315.46 g/mol, XLogP of 5.32, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-3-phenylpropan-1-amine is sourced from PubChem (CID 3867567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).