3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide

C14H19N4- — CID 143441110

IUPAC3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide
SMILESC=C1C=C(C2CCN(C)CC2)[N-]c2c(C)cnn21
InChIInChI=1S/C14H19N4/c1-10-9-15-18-11(2)8-13(16-14(10)18)12-4-6-17(3)7-5-12/h8-9,12H,2,4-7H2,1,3H3/q-1
InChIKeyRVIDNZHDTLGHMX-UHFFFAOYSA-N
MW243.33 g/mol
LogP2.91
Rot. Bonds1

About 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide

3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide (PubChem CID 143441110) has the molecular formula C14H19N4- and a molecular weight of 243.33 g/mol. Its IUPAC name is 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide.

Molecular Properties

Compound Name3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide
PubChem CID143441110
Molecular FormulaC14H19N4-
Molecular Weight243.33 g/mol
Exact Mass243.16
IUPAC Name3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide
SMILESC=C1C=C(C2CCN(C)CC2)[N-]c2c(C)cnn21
InChIInChI=1S/C14H19N4/c1-10-9-15-18-11(2)8-13(16-14(10)18)12-4-6-17(3)7-5-12/h8-9,12H,2,4-7H2,1,3H3/q-1
InChIKeyRVIDNZHDTLGHMX-UHFFFAOYSA-N
XLogP2.91
TPSA35.16 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-Cyclohexyl-4-methyl-7-methylidenepyrazolo[1,5-a]pyrimidine
CID 89058500
7-methylidene-6-propan-2-yl-5-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 144917454
2-(methylideneamino)-N-[(7-piperidin-4-yl-4,5-dihydropyrazolo[1,5-a]pyrimidin-3-yl)methylidene]ethanimidamide
CID 163742876
1-(3,5-Dimethylcyclohexa-1,5-dien-1-yl)-4-iodo-6,7-dihydropyrazolo[5,4-d]pyrimidine
CID 163822384
3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)-4H-pyrazolo[1,5-a]pyrimidine
CID 143441111

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide?
The IUPAC name of 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide (CID 143441110) is 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide.
What is the SMILES notation for 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide?
The canonical SMILES for 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide is C=C1C=C(C2CCN(C)CC2)[N-]c2c(C)cnn21.
What is the InChIKey of 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide?
The InChIKey is RVIDNZHDTLGHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N4/c1-10-9-15-18-11(2)8-13(16-14(10)18)12-4-6-17(3)7-5-12/h8-9,12H,2,4-7H2,1,3H3/q-1.
What are the key properties of 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide?
3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide has a molecular weight of 243.33 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-methylidene-5-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrimidin-4-ide is sourced from PubChem (CID 143441110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).