N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide

C14H18N4O2 — CID 46395130

IUPACN-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide
SMILESCc1nn(C)c2c(=O)n(C(C)C(=O)NC3CC3)ccc12
InChIInChI=1S/C14H18N4O2/c1-8-11-6-7-18(14(20)12(11)17(3)16-8)9(2)13(19)15-10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,15,19)
InChIKeyXRQDZNMBMAUVIR-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.88
Rot. Bonds3

About N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide

N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide (PubChem CID 46395130) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide
PubChem CID46395130
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide
SMILESCc1nn(C)c2c(=O)n(C(C)C(=O)NC3CC3)ccc12
InChIInChI=1S/C14H18N4O2/c1-8-11-6-7-18(14(20)12(11)17(3)16-8)9(2)13(19)15-10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,15,19)
InChIKeyXRQDZNMBMAUVIR-UHFFFAOYSA-N
XLogP0.88
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide?
The IUPAC name of N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide (CID 46395130) is N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide?
The canonical SMILES for N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide is Cc1nn(C)c2c(=O)n(C(C)C(=O)NC3CC3)ccc12.
What is the InChIKey of N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide?
The InChIKey is XRQDZNMBMAUVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-8-11-6-7-18(14(20)12(11)17(3)16-8)9(2)13(19)15-10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,15,19).
What are the key properties of N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide?
N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide has a molecular weight of 274.32 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide is sourced from PubChem (CID 46395130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).