N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide

C14H18N4O3 — CID 156890662

IUPACN-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCC(C)Cn1c(O)c(C(=O)NC2CC2)c(=O)n2nccc12
InChIInChI=1S/C14H18N4O3/c1-8(2)7-17-10-5-6-15-18(10)14(21)11(13(17)20)12(19)16-9-3-4-9/h5-6,8-9,20H,3-4,7H2,1-2H3,(H,16,19)
InChIKeyDGDJWIGGMFVDNB-UHFFFAOYSA-N
MW290.32 g/mol
LogP0.75
Rot. Bonds4

About N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide

N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 156890662) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID156890662
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC NameN-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCC(C)Cn1c(O)c(C(=O)NC2CC2)c(=O)n2nccc12
InChIInChI=1S/C14H18N4O3/c1-8(2)7-17-10-5-6-15-18(10)14(21)11(13(17)20)12(19)16-9-3-4-9/h5-6,8-9,20H,3-4,7H2,1-2H3,(H,16,19)
InChIKeyDGDJWIGGMFVDNB-UHFFFAOYSA-N
XLogP0.75
TPSA88.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

CID 156890602
CID 156890602
CID 171053822
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CID 171664847
CID 171664847
CID 25231737
CID 25231737
CID 135706081
CID 135706081
CID 135872744
CID 135872744
CID 136325375
CID 136325375
CID 137161549
CID 137161549
CID 137221594
CID 137221594
CID 142655499
CID 142655499
CID 150397729
CID 150397729
CID 156890441
CID 156890441

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide (CID 156890662) is N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide is CC(C)Cn1c(O)c(C(=O)NC2CC2)c(=O)n2nccc12.
What is the InChIKey of N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is DGDJWIGGMFVDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-8(2)7-17-10-5-6-15-18(10)14(21)11(13(17)20)12(19)16-9-3-4-9/h5-6,8-9,20H,3-4,7H2,1-2H3,(H,16,19).
What are the key properties of N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide?
N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-hydroxy-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 156890662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).