methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate

C14H16ClN3O2 — CID 117251573

IUPACmethyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2c(C3CCN(C)C3)nc(Cl)c2c1
InChIInChI=1S/C14H16ClN3O2/c1-17-5-3-10(8-17)13-16-12(15)11-7-9(14(19)20-2)4-6-18(11)13/h4,6-7,10H,3,5,8H2,1-2H3
InChIKeyHUUFSXUPALDAPN-UHFFFAOYSA-N
MW293.75 g/mol
LogP2.19
Rot. Bonds2

About methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate

methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate (PubChem CID 117251573) has the molecular formula C14H16ClN3O2 and a molecular weight of 293.75 g/mol. Its IUPAC name is methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate
PubChem CID117251573
Molecular FormulaC14H16ClN3O2
Molecular Weight293.75 g/mol
Exact Mass293.09
IUPAC Namemethyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2c(C3CCN(C)C3)nc(Cl)c2c1
InChIInChI=1S/C14H16ClN3O2/c1-17-5-3-10(8-17)13-16-12(15)11-7-9(14(19)20-2)4-6-18(11)13/h4,6-7,10H,3,5,8H2,1-2H3
InChIKeyHUUFSXUPALDAPN-UHFFFAOYSA-N
XLogP2.19
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117250338
7-methoxycarbonyl-3-(oxolan-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251578
1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251569
methyl 1-chloro-3-(2-methylpropyl)imidazo[1,5-a]pyridine-7-carboxylate
CID 117251812
1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-8-ol
CID 117252180
methyl 1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-7-carboxylate
CID 117251991
methyl 3-benzyl-1-chloroimidazo[1,5-a]pyridine-7-carboxylate
CID 117251796
1-chloro-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-7-ol
CID 117251610
methyl 1-chloro-3-(thian-4-yl)imidazo[1,5-a]pyridine-6-carboxylate
CID 117251063
1-chloro-3-(1-propan-2-ylpiperidin-4-yl)imidazo[1,5-a]pyridin-7-ol
CID 117251680
3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147381
1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117250339

Frequently Asked Questions

What is the IUPAC name of methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate?
The IUPAC name of methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate (CID 117251573) is methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate.
What is the SMILES notation for methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate?
The canonical SMILES for methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate is COC(=O)c1ccn2c(C3CCN(C)C3)nc(Cl)c2c1.
What is the InChIKey of methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate?
The InChIKey is HUUFSXUPALDAPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2/c1-17-5-3-10(8-17)13-16-12(15)11-7-9(14(19)20-2)4-6-18(11)13/h4,6-7,10H,3,5,8H2,1-2H3.
What are the key properties of methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate?
methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate has a molecular weight of 293.75 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-7-carboxylate is sourced from PubChem (CID 117251573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).