N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine

C14H22N2 — CID 60974257

IUPACN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCCC1C
InChIInChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3
InChIKeySYFKSDIBXUSGIO-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.96
Rot. Bonds3

About N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine

N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine (PubChem CID 60974257) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
PubChem CID60974257
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCCC1C
InChIInChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3
InChIKeySYFKSDIBXUSGIO-UHFFFAOYSA-N
XLogP2.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[2-(2-methylazetidin-1-yl)phenyl]ethanamine
CID 79678667
N-methyl-1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 43284088
3-[1-[2-[1-(methylamino)ethyl]phenyl]pyrrolidin-2-yl]propan-1-ol
CID 62467578
(1S)-1-[2-(2-methylazepan-1-yl)phenyl]propan-1-ol
CID 103960186
1-[2-(4,4-dimethylpiperidin-1-yl)phenyl]-N-methylethanamine
CID 62936574
1-[1-[2-[1-(methylamino)ethyl]phenyl]piperidin-4-yl]ethanol
CID 106836301
[1-[2-[1-(methylamino)ethyl]phenyl]piperidin-4-yl]methanol
CID 43284506
N-methyl-1-[2-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
CID 63778753
8-[2-[1-(methylamino)ethyl]phenyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63762238
1-[2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]phenyl]-N-methylpropan-1-amine
CID 102726801
1-[2-fluoro-6-(2-methylpyrrolidin-1-yl)phenyl]ethanol
CID 60974750
1-[2-[1-(methylamino)ethyl]phenyl]-1,3-diazinan-2-one
CID 65295411

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine (CID 60974257) is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine is CNC(C)c1ccccc1N1CCCC1C.
What is the InChIKey of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The InChIKey is SYFKSDIBXUSGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3.
What are the key properties of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine is sourced from PubChem (CID 60974257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).