[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid

C19H24N4O4 — CID 134328691

IUPAC[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid
SMILESO=C(O)NCC(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1
InChIInChI=1S/C19H24N4O4/c24-16(9-21-19(26)27)22-6-1-2-13(10-22)18(25)17-14(12-3-4-12)5-7-23-11-20-8-15(17)23/h5,7-8,11-13,18,21,25H,1-4,6,9-10H2,(H,26,27)
InChIKeyGWNJCYNYENJTED-UHFFFAOYSA-N
MW372.43 g/mol
LogP1.75
Rot. Bonds5

About [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid

[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid (PubChem CID 134328691) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid.

Molecular Properties

Compound Name[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid
PubChem CID134328691
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid
SMILESO=C(O)NCC(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1
InChIInChI=1S/C19H24N4O4/c24-16(9-21-19(26)27)22-6-1-2-13(10-22)18(25)17-14(12-3-4-12)5-7-23-11-20-8-15(17)23/h5,7-8,11-13,18,21,25H,1-4,6,9-10H2,(H,26,27)
InChIKeyGWNJCYNYENJTED-UHFFFAOYSA-N
XLogP1.75
TPSA107.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid?
The IUPAC name of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid (CID 134328691) is [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid.
What is the SMILES notation for [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid?
The canonical SMILES for [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid is O=C(O)NCC(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1.
What is the InChIKey of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid?
The InChIKey is GWNJCYNYENJTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c24-16(9-21-19(26)27)22-6-1-2-13(10-22)18(25)17-14(12-3-4-12)5-7-23-11-20-8-15(17)23/h5,7-8,11-13,18,21,25H,1-4,6,9-10H2,(H,26,27).
What are the key properties of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid?
[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid has a molecular weight of 372.43 g/mol, XLogP of 1.75, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl]carbamic acid is sourced from PubChem (CID 134328691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).