N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine

C13H20N2 — CID 3072374

IUPACN,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine
SMILESCN(C)CC1CCCN1c1ccccc1
InChIInChI=1S/C13H20N2/c1-14(2)11-13-9-6-10-15(13)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3
InChIKeyFTASZDRLMJMLPQ-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.22
Rot. Bonds3

About N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine

N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine (PubChem CID 3072374) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine
PubChem CID3072374
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine
SMILESCN(C)CC1CCCN1c1ccccc1
InChIInChI=1S/C13H20N2/c1-14(2)11-13-9-6-10-15(13)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3
InChIKeyFTASZDRLMJMLPQ-UHFFFAOYSA-N
XLogP2.22
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dimethylaniline
CID 949
N,N-Diethyl-p-phenylenediamine
CID 7120
N,N-Diethylaniline
CID 7061
N-Isopropylaniline
CID 13032
N,N,N',N'-tetramethyl-p-phenylenediamine
CID 7490
N,N'-Di-sec-butyl-p-phenylenediamine
CID 7589
1,1-Dimethyl-4-phenylpiperazinium iodide
CID 5911
Trimethylphenylammonium iodide
CID 94135
N,N-Diethyl-p-phenylenediamine hydrochloride
CID 75145
Phenyltrimethylammonium chloride
CID 67309
1,2-Ethanediamine, N1-ethyl-N2,N2-dimethyl-N1-phenyl-
CID 33984
3-(Ethylphenylamino)propanenitrile
CID 8995

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine (CID 3072374) is N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine is CN(C)CC1CCCN1c1ccccc1.
What is the InChIKey of N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine?
The InChIKey is FTASZDRLMJMLPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-14(2)11-13-9-6-10-15(13)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine?
N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine has a molecular weight of 204.32 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1-phenylpyrrolidin-2-yl)methanamine is sourced from PubChem (CID 3072374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).