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

C19H24N4O4 — CID 134328726

IUPAC[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate
SMILESNC(=O)OCC(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1
InChIInChI=1S/C19H24N4O4/c20-19(26)27-10-16(24)22-6-1-2-13(9-22)18(25)17-14(12-3-4-12)5-7-23-11-21-8-15(17)23/h5,7-8,11-13,18,25H,1-4,6,9-10H2,(H2,20,26)
InChIKeyFJXPRQOPYZMZSP-UHFFFAOYSA-N
MW372.43 g/mol
LogP1.58
Rot. Bonds5

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

[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate (PubChem CID 134328726) 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] carbamate.

Molecular Properties

Compound Name[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate
PubChem CID134328726
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] carbamate
SMILESNC(=O)OCC(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1
InChIInChI=1S/C19H24N4O4/c20-19(26)27-10-16(24)22-6-1-2-13(9-22)18(25)17-14(12-3-4-12)5-7-23-11-21-8-15(17)23/h5,7-8,11-13,18,25H,1-4,6,9-10H2,(H2,20,26)
InChIKeyFJXPRQOPYZMZSP-UHFFFAOYSA-N
XLogP1.58
TPSA110.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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] carbamate?
The IUPAC name of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate (CID 134328726) is [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate.
What is the SMILES notation for [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate?
The canonical SMILES for [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate is NC(=O)OCC(=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] carbamate?
The InChIKey is FJXPRQOPYZMZSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c20-19(26)27-10-16(24)22-6-1-2-13(9-22)18(25)17-14(12-3-4-12)5-7-23-11-21-8-15(17)23/h5,7-8,11-13,18,25H,1-4,6,9-10H2,(H2,20,26).
What are the key properties of [2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate?
[2-[3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidin-1-yl]-2-oxoethyl] carbamate has a molecular weight of 372.43 g/mol, XLogP of 1.58, 5 rotatable bonds, 2 hydrogen bond donors, and 6 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] carbamate is sourced from PubChem (CID 134328726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).