N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine

C14H22N2 — CID 23292007

IUPACN-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCC(c1ccccc1)N(C)CC1CCNC1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)16(2)11-13-8-9-15-10-13/h3-7,12-13,15H,8-11H2,1-2H3
InChIKeyYAQVUKXLGVEJBT-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.29
Rot. Bonds4

About N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine

N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine (PubChem CID 23292007) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine
PubChem CID23292007
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCC(c1ccccc1)N(C)CC1CCNC1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)16(2)11-13-8-9-15-10-13/h3-7,12-13,15H,8-11H2,1-2H3
InChIKeyYAQVUKXLGVEJBT-UHFFFAOYSA-N
XLogP2.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine
CID 78880741
1-(3-chlorophenyl)-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride
CID 119930141
(3R)-3-[(2R)-2-phenylpropyl]pyrrolidine
CID 86324114
2-[1-[methyl(piperidin-3-ylmethyl)amino]ethyl]phenol
CID 104870411
1-(2-chlorophenyl)-N-methyl-N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 112736627
N-benzyl-N-[[(3R)-pyrrolidin-3-yl]methyl]propan-2-amine
CID 94408590
N-benzyl-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 56831736
N-methyl-2-phenyl-N-(piperidin-3-ylmethyl)propan-1-amine;hydrochloride
CID 119931376
N-methyl-1-(4-methylsulfinylphenyl)-N-(piperidin-4-ylmethyl)ethanamine
CID 119932369
N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106623701
N-methyl-N-(piperidin-3-ylmethyl)-1-pyridin-2-ylethanamine
CID 71637592
N-methyl-4-phenyl-N-(piperidin-4-ylmethyl)butan-2-amine
CID 79707519

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The IUPAC name of N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine (CID 23292007) is N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine is CC(c1ccccc1)N(C)CC1CCNC1.
What is the InChIKey of N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The InChIKey is YAQVUKXLGVEJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)16(2)11-13-8-9-15-10-13/h3-7,12-13,15H,8-11H2,1-2H3.
What are the key properties of N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine is sourced from PubChem (CID 23292007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).