N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine

C15H22N2 — CID 106614320

IUPACN-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine
SMILESC=C(CN(C)CC1CCCN1)c1ccccc1
InChIInChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)11-17(2)12-15-9-6-10-16-15/h3-5,7-8,15-16H,1,6,9-12H2,2H3
InChIKeyIPYAZZVOUATDHO-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.38
Rot. Bonds5

About N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine

N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine (PubChem CID 106614320) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine
PubChem CID106614320
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC NameN-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine
SMILESC=C(CN(C)CC1CCCN1)c1ccccc1
InChIInChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)11-17(2)12-15-9-6-10-16-15/h3-5,7-8,15-16H,1,6,9-12H2,2H3
InChIKeyIPYAZZVOUATDHO-UHFFFAOYSA-N
XLogP2.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1,1-diphenyl-N-(pyrrolidin-2-ylmethyl)methanamine
CID 106602654
2-[methyl-[[(2R)-piperidin-2-yl]methyl]amino]-1-pyridin-2-ylethanone
CID 97164226
N-phenyl-N-(pyrrolidin-2-ylmethyl)aniline
CID 69019447
N-(2-methoxyphenyl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106613869
(E)-N-methyl-3-phenyl-N-(piperidin-2-ylmethyl)prop-2-en-1-amine
CID 106635606
N-[(4-fluorophenyl)methyl]-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 61412988
2-[methyl(piperidin-2-ylmethyl)amino]-1-(1H-pyrrol-2-yl)ethanone
CID 71641896
N,2-dimethyl-1-phenyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106602398
N-(3-iodophenyl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614250
1,1-diphenyl-2-[(2R)-pyrrolidin-2-yl]ethanol
CID 89497125
1-phenyl-2-pyrrolidin-2-ylethanone
CID 14176779
N-ethyl-N-methyl-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614264

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine?
The IUPAC name of N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine (CID 106614320) is N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine.
What is the SMILES notation for N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine?
The canonical SMILES for N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine is C=C(CN(C)CC1CCCN1)c1ccccc1.
What is the InChIKey of N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine?
The InChIKey is IPYAZZVOUATDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)11-17(2)12-15-9-6-10-16-15/h3-5,7-8,15-16H,1,6,9-12H2,2H3.
What are the key properties of N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine?
N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine has a molecular weight of 230.36 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)prop-2-en-1-amine is sourced from PubChem (CID 106614320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).