3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

C12H16N2O2 — CID 83837678

IUPAC3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC1CCn2c(C3CC3)nc(C(=O)O)c2C1
InChIInChI=1S/C12H16N2O2/c1-7-4-5-14-9(6-7)10(12(15)16)13-11(14)8-2-3-8/h7-8H,2-6H2,1H3,(H,15,16)
InChIKeyPDNMOFSCTNNOHF-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.04
Rot. Bonds2

About 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 83837678) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID83837678
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC1CCn2c(C3CC3)nc(C(=O)O)c2C1
InChIInChI=1S/C12H16N2O2/c1-7-4-5-14-9(6-7)10(12(15)16)13-11(14)8-2-3-8/h7-8H,2-6H2,1H3,(H,15,16)
InChIKeyPDNMOFSCTNNOHF-UHFFFAOYSA-N
XLogP2.04
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methyl-3-(methylaminomethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117247240
3-[(dimethylamino)methyl]-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117247241
3-(1-ethylpiperidin-4-yl)-7-hydroxy-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249036
3-(2-hydroxyphenyl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 137005501
7-methyl-3-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249158
4-(1-chloro-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)thiane 1,1-dioxide
CID 117249040
3-(3-chlorophenyl)-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249323
1-chloro-7-methyl-3-(oxan-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249038
N,3,7-trimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 112552032
N,N,7-trimethyl-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 112552665
1-bromo-7-methyl-3-pyrrolidin-3-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117248968
8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249726

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (CID 83837678) is 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is CC1CCn2c(C3CC3)nc(C(=O)O)c2C1.
What is the InChIKey of 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is PDNMOFSCTNNOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-7-4-5-14-9(6-7)10(12(15)16)13-11(14)8-2-3-8/h7-8H,2-6H2,1H3,(H,15,16).
What are the key properties of 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 220.27 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-7-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 83837678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).