(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone

C18H17N5O2 — CID 169166339

IUPAC(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
SMILESO=C(c1oc(-c2ccccn2)nc1C1CC1)N1CCc2nc[nH]c2C1
InChIInChI=1S/C18H17N5O2/c24-18(23-8-6-12-14(9-23)21-10-20-12)16-15(11-4-5-11)22-17(25-16)13-3-1-2-7-19-13/h1-3,7,10-11H,4-6,8-9H2,(H,20,21)
InChIKeyZRQUAZWQNQKFBJ-UHFFFAOYSA-N
MW335.37 g/mol
LogP2.54
Rot. Bonds3

About (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone

(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone (PubChem CID 169166339) has the molecular formula C18H17N5O2 and a molecular weight of 335.37 g/mol. Its IUPAC name is (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Name(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
PubChem CID169166339
Molecular FormulaC18H17N5O2
Molecular Weight335.37 g/mol
Exact Mass335.14
IUPAC Name(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
SMILESO=C(c1oc(-c2ccccn2)nc1C1CC1)N1CCc2nc[nH]c2C1
InChIInChI=1S/C18H17N5O2/c24-18(23-8-6-12-14(9-23)21-10-20-12)16-15(11-4-5-11)22-17(25-16)13-3-1-2-7-19-13/h1-3,7,10-11H,4-6,8-9H2,(H,20,21)
InChIKeyZRQUAZWQNQKFBJ-UHFFFAOYSA-N
XLogP2.54
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The IUPAC name of (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone (CID 169166339) is (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone.
What is the SMILES notation for (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The canonical SMILES for (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone is O=C(c1oc(-c2ccccn2)nc1C1CC1)N1CCc2nc[nH]c2C1.
What is the InChIKey of (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The InChIKey is ZRQUAZWQNQKFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O2/c24-18(23-8-6-12-14(9-23)21-10-20-12)16-15(11-4-5-11)22-17(25-16)13-3-1-2-7-19-13/h1-3,7,10-11H,4-6,8-9H2,(H,20,21).
What are the key properties of (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
(4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone has a molecular weight of 335.37 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-2-pyridin-2-yl-1,3-oxazol-5-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone is sourced from PubChem (CID 169166339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).