3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

C18H25N3O2 — CID 90815671

IUPAC3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCC1(CO)CCCC1)C1=C2C=CC=CN2C(C2CC2)N1
InChIInChI=1S/C18H25N3O2/c22-12-18(8-2-3-9-18)11-19-17(23)15-14-5-1-4-10-21(14)16(20-15)13-6-7-13/h1,4-5,10,13,16,20,22H,2-3,6-9,11-12H2,(H,19,23)
InChIKeyQQMAGCOMWQBEOS-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.59
Rot. Bonds5

About 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 90815671) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID90815671
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NCC1(CO)CCCC1)C1=C2C=CC=CN2C(C2CC2)N1
InChIInChI=1S/C18H25N3O2/c22-12-18(8-2-3-9-18)11-19-17(23)15-14-5-1-4-10-21(14)16(20-15)13-6-7-13/h1,4-5,10,13,16,20,22H,2-3,6-9,11-12H2,(H,19,23)
InChIKeyQQMAGCOMWQBEOS-UHFFFAOYSA-N
XLogP1.59
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (CID 90815671) is 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is O=C(NCC1(CO)CCCC1)C1=C2C=CC=CN2C(C2CC2)N1.
What is the InChIKey of 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is QQMAGCOMWQBEOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c22-12-18(8-2-3-9-18)11-19-17(23)15-14-5-1-4-10-21(14)16(20-15)13-6-7-13/h1,4-5,10,13,16,20,22H,2-3,6-9,11-12H2,(H,19,23).
What are the key properties of 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 1.59, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 90815671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).