2-(4-methoxy-3-methylphenyl)indolizin-1-amine

C16H16N2O — CID 82377823

IUPAC2-(4-methoxy-3-methylphenyl)indolizin-1-amine
SMILESCOc1ccc(-c2cn3ccccc3c2N)cc1C
InChIInChI=1S/C16H16N2O/c1-11-9-12(6-7-15(11)19-2)13-10-18-8-4-3-5-14(18)16(13)17/h3-10H,17H2,1-2H3
InChIKeyZVTXCIMGHUEVEV-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.51
Rot. Bonds2

About 2-(4-methoxy-3-methylphenyl)indolizin-1-amine

2-(4-methoxy-3-methylphenyl)indolizin-1-amine (PubChem CID 82377823) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-(4-methoxy-3-methylphenyl)indolizin-1-amine.

Molecular Properties

Compound Name2-(4-methoxy-3-methylphenyl)indolizin-1-amine
PubChem CID82377823
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2-(4-methoxy-3-methylphenyl)indolizin-1-amine
SMILESCOc1ccc(-c2cn3ccccc3c2N)cc1C
InChIInChI=1S/C16H16N2O/c1-11-9-12(6-7-15(11)19-2)13-10-18-8-4-3-5-14(18)16(13)17/h3-10H,17H2,1-2H3
InChIKeyZVTXCIMGHUEVEV-UHFFFAOYSA-N
XLogP3.51
TPSA39.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxy-3-methylphenyl)phenol
CID 53218559
2-(3-methyl-4-phenylmethoxyphenyl)indolizine-1-carboxylic acid
CID 4518070
2-(3-chloro-4-methoxyphenyl)indolizine-1-carboxylic acid
CID 4307443
2-(3-bromo-4-methoxyphenyl)indolizine-1-carboxylic acid
CID 3360201
3-(4-methoxy-3-methylphenyl)-4-methylaniline
CID 55202323
5-(4-methoxy-3-methylphenyl)-3-(2-methylphenyl)triazol-4-amine
CID 82370481
methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
CID 161175155
2-[5-amino-4-(4-methoxy-3-methylphenyl)triazol-1-yl]phenol
CID 82370610
2-(4-methoxy-3-methylphenyl)benzaldehyde
CID 54910312
4-[2-(chloromethyl)phenyl]-1-methoxy-2-methylbenzene
CID 126696020
3-fluoro-4-(4-methoxy-3-methylphenyl)aniline
CID 65436397
[4-fluoro-3-(4-methoxy-3-methylphenyl)phenyl]methanamine
CID 54910100

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-methylphenyl)indolizin-1-amine?
The IUPAC name of 2-(4-methoxy-3-methylphenyl)indolizin-1-amine (CID 82377823) is 2-(4-methoxy-3-methylphenyl)indolizin-1-amine.
What is the SMILES notation for 2-(4-methoxy-3-methylphenyl)indolizin-1-amine?
The canonical SMILES for 2-(4-methoxy-3-methylphenyl)indolizin-1-amine is COc1ccc(-c2cn3ccccc3c2N)cc1C.
What is the InChIKey of 2-(4-methoxy-3-methylphenyl)indolizin-1-amine?
The InChIKey is ZVTXCIMGHUEVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-11-9-12(6-7-15(11)19-2)13-10-18-8-4-3-5-14(18)16(13)17/h3-10H,17H2,1-2H3.
What are the key properties of 2-(4-methoxy-3-methylphenyl)indolizin-1-amine?
2-(4-methoxy-3-methylphenyl)indolizin-1-amine has a molecular weight of 252.32 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-methylphenyl)indolizin-1-amine is sourced from PubChem (CID 82377823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).