2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine

C19H34N2 — CID 115463638

IUPAC2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine
SMILESCCCN(Cc1ccccc1CCNC(C)(C)C)C(C)C
InChIInChI=1S/C19H34N2/c1-7-14-21(16(2)3)15-18-11-9-8-10-17(18)12-13-20-19(4,5)6/h8-11,16,20H,7,12-15H2,1-6H3
InChIKeyMGXYHFUQLOYKJB-UHFFFAOYSA-N
MW290.50 g/mol
LogP4.24
Rot. Bonds8

About 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine

2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine (PubChem CID 115463638) has the molecular formula C19H34N2 and a molecular weight of 290.50 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine
PubChem CID115463638
Molecular FormulaC19H34N2
Molecular Weight290.50 g/mol
Exact Mass290.27
IUPAC Name2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine
SMILESCCCN(Cc1ccccc1CCNC(C)(C)C)C(C)C
InChIInChI=1S/C19H34N2/c1-7-14-21(16(2)3)15-18-11-9-8-10-17(18)12-13-20-19(4,5)6/h8-11,16,20H,7,12-15H2,1-6H3
InChIKeyMGXYHFUQLOYKJB-UHFFFAOYSA-N
XLogP4.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.50
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-[2-(tert-butylamino)ethyl]phenyl]methyl]-N-methylbutan-2-amine
CID 115463579
N-[[2-[2-(tert-butylamino)ethyl]phenyl]methyl]-N,3-dimethylbutan-2-amine
CID 115463732
2-[[propan-2-yl(propyl)amino]methyl]phenol
CID 79038025
2-methyl-N-[[3-[[propan-2-yl(propyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 55075072
N-[[2-[2-(ethylamino)ethyl]phenyl]methyl]-N-propylpropan-1-amine
CID 115463481
N-[[2-[2-(ethylamino)ethyl]phenyl]methyl]-N-methylpentan-2-amine
CID 115463757
N'-benzyl-N-tert-butyl-N'-propan-2-ylpentane-1,5-diamine
CID 62423459
N-[[2-[(dipropylamino)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 62425451
2-[[propan-2-yl(propyl)amino]methyl]benzohydrazide
CID 55212652
2-[2-(tert-butylamino)ethyl]benzonitrile
CID 107937025
N-[[2-(aminomethyl)phenyl]methyl]-N-propan-2-ylpentan-1-amine
CID 55001809
N-[2-[2-[[ethyl(propyl)amino]methyl]phenyl]ethyl]propan-1-amine
CID 115463617

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine (CID 115463638) is 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine is CCCN(Cc1ccccc1CCNC(C)(C)C)C(C)C.
What is the InChIKey of 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine?
The InChIKey is MGXYHFUQLOYKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2/c1-7-14-21(16(2)3)15-18-11-9-8-10-17(18)12-13-20-19(4,5)6/h8-11,16,20H,7,12-15H2,1-6H3.
What are the key properties of 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine?
2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine has a molecular weight of 290.50 g/mol, XLogP of 4.24, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-[[propan-2-yl(propyl)amino]methyl]phenyl]ethyl]propan-2-amine is sourced from PubChem (CID 115463638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).