N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine

C19H26N2 — CID 43271829

IUPACN-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)Cc1ccc(-c2ccccc2CN)cc1
InChIInChI=1S/C19H26N2/c1-15(2)13-21(3)14-16-8-10-17(11-9-16)19-7-5-4-6-18(19)12-20/h4-11,15H,12-14,20H2,1-3H3
InChIKeyMDOAJURMFHCSMC-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.90
Rot. Bonds6

About N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine

N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine (PubChem CID 43271829) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine
PubChem CID43271829
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)Cc1ccc(-c2ccccc2CN)cc1
InChIInChI=1S/C19H26N2/c1-15(2)13-21(3)14-16-8-10-17(11-9-16)19-7-5-4-6-18(19)12-20/h4-11,15H,12-14,20H2,1-3H3
InChIKeyMDOAJURMFHCSMC-UHFFFAOYSA-N
XLogP3.90
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[4-(propan-2-ylsulfonylmethyl)phenyl]phenyl]methanamine
CID 64697236
ethane;(2-phenylphenyl)methanamine
CID 142592948
N-[[3-(aminomethyl)furan-2-yl]methyl]-N,2-dimethylpropan-1-amine
CID 62422966
4-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-3-methylbutan-1-amine
CID 82542355
2-[4-[[methyl(2-methylpropyl)amino]methyl]phenyl]acetic acid
CID 105345659
N-[[2-(3-aminoprop-1-ynyl)phenyl]methyl]-N,2-dimethylpropan-1-amine
CID 54969275
[4-[(2R,4S,5S,6R)-2-[4-[2-(aminomethyl)phenyl]phenyl]-6-[[benzyl(methyl)amino]methyl]-5-methyl-1,3-dioxan-4-yl]phenyl]methanol
CID 6689173
N-[(4-ethenylphenyl)methyl]-N,2-dimethylpropan-1-amine
CID 144849725
N-[[2-(aminomethyl)phenyl]methyl]-2,2-difluoro-N-methylethanamine
CID 60922084
[2-[4-(phenoxymethyl)phenyl]phenyl]methanamine
CID 43825120
[4-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]phenyl]methanamine
CID 60921319
[2-[4-(2-methylbutan-2-yloxymethyl)phenyl]phenyl]methanamine
CID 28996319

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine (CID 43271829) is N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine is CC(C)CN(C)Cc1ccc(-c2ccccc2CN)cc1.
What is the InChIKey of N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine?
The InChIKey is MDOAJURMFHCSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-15(2)13-21(3)14-16-8-10-17(11-9-16)19-7-5-4-6-18(19)12-20/h4-11,15H,12-14,20H2,1-3H3.
What are the key properties of N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine?
N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine has a molecular weight of 282.43 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[2-(aminomethyl)phenyl]phenyl]methyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 43271829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).