1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine

C15H19ClN2 — CID 116993733

IUPAC1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine
SMILESCc1c(Cl)c2ccccn2c1CC1CCCCN1
InChIInChI=1S/C15H19ClN2/c1-11-14(10-12-6-2-4-8-17-12)18-9-5-3-7-13(18)15(11)16/h3,5,7,9,12,17H,2,4,6,8,10H2,1H3
InChIKeyUIFIUAOSNAEQNQ-UHFFFAOYSA-N
MW262.78 g/mol
LogP3.59
Rot. Bonds2

About 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine

1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine (PubChem CID 116993733) has the molecular formula C15H19ClN2 and a molecular weight of 262.78 g/mol. Its IUPAC name is 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine.

Molecular Properties

Compound Name1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine
PubChem CID116993733
Molecular FormulaC15H19ClN2
Molecular Weight262.78 g/mol
Exact Mass262.12
IUPAC Name1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine
SMILESCc1c(Cl)c2ccccn2c1CC1CCCCN1
InChIInChI=1S/C15H19ClN2/c1-11-14(10-12-6-2-4-8-17-12)18-9-5-3-7-13(18)15(11)16/h3,5,7,9,12,17H,2,4,6,8,10H2,1H3
InChIKeyUIFIUAOSNAEQNQ-UHFFFAOYSA-N
XLogP3.59
TPSA16.44 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chloro-3-methylphenyl)methyl]pyrrolidine
CID 117299743
2-[(2-chloro-3-fluoro-4-methylphenyl)methyl]pyrrolidine
CID 117327912
2-[(2-chloro-3-fluorophenyl)methyl]azepane
CID 112654464
3-chloro-1-methyl-4-(piperidin-2-ylmethyl)indole
CID 117411537
3-methyl-1-(piperidin-2-ylmethyl)indazole
CID 84793021
(2R)-2-[(2-methylphenyl)methyl]pyrrolidine
CID 7047857
3-chloro-1-methyl-4-(piperidin-2-ylmethyl)indazole
CID 117414218
1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117254735
2-[(2-chloro-3,5-dimethylphenyl)methyl]piperidine
CID 117348318
2-[(2-chloro-3-fluorophenyl)methyl]pyrrolidine
CID 112654463
2-(azepan-2-ylmethyl)-1-methylbenzimidazole
CID 79750642
(2R)-2-[(4-methylphenyl)methyl]piperidine
CID 7048103

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine?
The IUPAC name of 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine (CID 116993733) is 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine.
What is the SMILES notation for 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine?
The canonical SMILES for 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine is Cc1c(Cl)c2ccccn2c1CC1CCCCN1.
What is the InChIKey of 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine?
The InChIKey is UIFIUAOSNAEQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2/c1-11-14(10-12-6-2-4-8-17-12)18-9-5-3-7-13(18)15(11)16/h3,5,7,9,12,17H,2,4,6,8,10H2,1H3.
What are the key properties of 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine?
1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine has a molecular weight of 262.78 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine is sourced from PubChem (CID 116993733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).