N,N-dibenzylpropan-1-amine

C17H21N — CID 10840212

IUPACN,N-dibenzylpropan-1-amine
SMILESCCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C17H21N/c1-2-13-18(14-16-9-5-3-6-10-16)15-17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3
InChIKeyUUCKZASIGJZKDT-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.10
Rot. Bonds6

About N,N-dibenzylpropan-1-amine

N,N-dibenzylpropan-1-amine (PubChem CID 10840212) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is N,N-dibenzylpropan-1-amine.

Molecular Properties

Compound NameN,N-dibenzylpropan-1-amine
PubChem CID10840212
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC NameN,N-dibenzylpropan-1-amine
SMILESCCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C17H21N/c1-2-13-18(14-16-9-5-3-6-10-16)15-17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3
InChIKeyUUCKZASIGJZKDT-UHFFFAOYSA-N
XLogP4.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-N-propylbutan-1-amine;ethane
CID 143530424
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CID 58570196
N-benzyl-N-propylhexan-1-amine
CID 123983090
N-benzyl-N-(methoxymethyl)propan-1-amine
CID 90983787
N,N-dibenzyldodecan-1-amine
CID 11508874
N,N-dibenzylnonan-1-amine;hydrochloride
CID 173190892
4-[benzyl(propyl)amino]butan-1-ol
CID 130822527
N,N-dibenzyl-1-phenylmethanamine;hexane
CID 174855522
N'-benzyl-N-phenyl-N'-propylethane-1,2-diamine
CID 90274197
N-benzyl-2-(bromomethyl)-N-propylbutan-1-amine
CID 130848534
1-N-benzyl-2-N-methyl-1-N-propylpropane-1,2-diamine
CID 131052434
N-benzyl-N-methyl-N',N'-dipropylbutane-1,4-diamine
CID 141125975

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylpropan-1-amine?
The IUPAC name of N,N-dibenzylpropan-1-amine (CID 10840212) is N,N-dibenzylpropan-1-amine.
What is the SMILES notation for N,N-dibenzylpropan-1-amine?
The canonical SMILES for N,N-dibenzylpropan-1-amine is CCCN(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylpropan-1-amine?
The InChIKey is UUCKZASIGJZKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-2-13-18(14-16-9-5-3-6-10-16)15-17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3.
What are the key properties of N,N-dibenzylpropan-1-amine?
N,N-dibenzylpropan-1-amine has a molecular weight of 239.36 g/mol, XLogP of 4.10, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylpropan-1-amine is sourced from PubChem (CID 10840212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).