indolizin-2-yl-(4-methylphenyl)methanamine

C16H16N2 — CID 118607591

IUPACindolizin-2-yl-(4-methylphenyl)methanamine
SMILESCc1ccc(C(N)c2cc3ccccn3c2)cc1
InChIInChI=1S/C16H16N2/c1-12-5-7-13(8-6-12)16(17)14-10-15-4-2-3-9-18(15)11-14/h2-11,16H,17H2,1H3
InChIKeyDMDYSFURZZOIGW-UHFFFAOYSA-N
MW236.32 g/mol
LogP3.30
Rot. Bonds2

About indolizin-2-yl-(4-methylphenyl)methanamine

indolizin-2-yl-(4-methylphenyl)methanamine (PubChem CID 118607591) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is indolizin-2-yl-(4-methylphenyl)methanamine.

Molecular Properties

Compound Nameindolizin-2-yl-(4-methylphenyl)methanamine
PubChem CID118607591
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Nameindolizin-2-yl-(4-methylphenyl)methanamine
SMILESCc1ccc(C(N)c2cc3ccccn3c2)cc1
InChIInChI=1S/C16H16N2/c1-12-5-7-13(8-6-12)16(17)14-10-15-4-2-3-9-18(15)11-14/h2-11,16H,17H2,1H3
InChIKeyDMDYSFURZZOIGW-UHFFFAOYSA-N
XLogP3.30
TPSA30.43 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dimethylphenyl)indolizine
CID 22425001
indolizine;toluene
CID 175477337
(3-fluoro-5-methylphenyl)-(4-methylphenyl)methanamine
CID 79704327
(4-methoxy-3,5-dimethylphenyl)-(4-methylphenyl)methanamine
CID 83056835
1-benzothiophen-2-yl-(4-methylphenyl)methanamine
CID 61406920
(4-methylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43095172
(4-methylphenyl)-(2,4,5-trimethoxyphenyl)methanamine
CID 43121496
(4-methoxy-3-methylphenyl)-(4-methylphenyl)methanamine
CID 43379645
(6-bromonaphthalen-2-yl)-(4-methylphenyl)methanamine
CID 115353742
(2-cyclobutylphenyl)-(4-methylphenyl)methanamine
CID 114602558
7-methyl-2-propan-2-ylindolizine;propane
CID 142104989
diphenylmethanamine;methanethiol
CID 143873840

Frequently Asked Questions

What is the IUPAC name of indolizin-2-yl-(4-methylphenyl)methanamine?
The IUPAC name of indolizin-2-yl-(4-methylphenyl)methanamine (CID 118607591) is indolizin-2-yl-(4-methylphenyl)methanamine.
What is the SMILES notation for indolizin-2-yl-(4-methylphenyl)methanamine?
The canonical SMILES for indolizin-2-yl-(4-methylphenyl)methanamine is Cc1ccc(C(N)c2cc3ccccn3c2)cc1.
What is the InChIKey of indolizin-2-yl-(4-methylphenyl)methanamine?
The InChIKey is DMDYSFURZZOIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-12-5-7-13(8-6-12)16(17)14-10-15-4-2-3-9-18(15)11-14/h2-11,16H,17H2,1H3.
What are the key properties of indolizin-2-yl-(4-methylphenyl)methanamine?
indolizin-2-yl-(4-methylphenyl)methanamine has a molecular weight of 236.32 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for indolizin-2-yl-(4-methylphenyl)methanamine is sourced from PubChem (CID 118607591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).