N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine

C16H22N4 — CID 106553535

IUPACN-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine
SMILESCNCC1CCCN1c1nc(C)cn1-c1ccccc1
InChIInChI=1S/C16H22N4/c1-13-12-20(14-7-4-3-5-8-14)16(18-13)19-10-6-9-15(19)11-17-2/h3-5,7-8,12,15,17H,6,9-11H2,1-2H3
InChIKeyOTMMIOBKXTTXLQ-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.37
Rot. Bonds4

About N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine

N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine (PubChem CID 106553535) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine
PubChem CID106553535
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC NameN-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine
SMILESCNCC1CCCN1c1nc(C)cn1-c1ccccc1
InChIInChI=1S/C16H22N4/c1-13-12-20(14-7-4-3-5-8-14)16(18-13)19-10-6-9-15(19)11-17-2/h3-5,7-8,12,15,17H,6,9-11H2,1-2H3
InChIKeyOTMMIOBKXTTXLQ-UHFFFAOYSA-N
XLogP2.37
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(1-cyclopentyl-4-methylimidazol-2-yl)pyrrolidin-2-yl]-N-methylmethanamine
CID 106553546
1-[1-[1-(1-methoxypropan-2-yl)-4-methylimidazol-2-yl]pyrrolidin-2-yl]-N-methylmethanamine
CID 106553545
1-[1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidin-2-yl]-N-methylmethanamine
CID 112635132
N-benzyl-1-(1-phenylpyrrolidin-2-yl)methanamine
CID 3072413
N-methyl-1-[1-(1-phenylpiperidin-4-yl)pyrrolidin-2-yl]methanamine
CID 104973831
(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine
CID 106553924
N-methyl-1-(1-quinolin-4-ylpyrrolidin-2-yl)methanamine
CID 62585638
[2-(methylaminomethyl)pyrrolidin-1-yl]-(3-methyl-1-phenylpyrazol-4-yl)methanone
CID 119650742
1-[1-(4-ethyl-1-propylimidazol-2-yl)piperidin-2-yl]-N-methylmethanamine
CID 106552936
4-[2-(methylaminomethyl)pyrrolidin-1-yl]benzonitrile
CID 83704659
2-(2-methylpropyl)-1-phenylpyrrolidine
CID 11241145
N-methyl-2-[2-(methylaminomethyl)pyrrolidin-1-yl]benzenesulfonamide
CID 115317043

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine (CID 106553535) is N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine is CNCC1CCCN1c1nc(C)cn1-c1ccccc1.
What is the InChIKey of N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine?
The InChIKey is OTMMIOBKXTTXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-13-12-20(14-7-4-3-5-8-14)16(18-13)19-10-6-9-15(19)11-17-2/h3-5,7-8,12,15,17H,6,9-11H2,1-2H3.
What are the key properties of N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine?
N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine has a molecular weight of 270.38 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(4-methyl-1-phenylimidazol-2-yl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 106553535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).