2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide

C10H16N4O — CID 165445223

IUPAC2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide
SMILESCC(C)C(=O)Nc1cnn2c1NCCC2
InChIInChI=1S/C10H16N4O/c1-7(2)10(15)13-8-6-12-14-5-3-4-11-9(8)14/h6-7,11H,3-5H2,1-2H3,(H,13,15)
InChIKeyNKTGDTOICMPPOL-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.29
Rot. Bonds2

About 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide

2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide (PubChem CID 165445223) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide
PubChem CID165445223
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide
SMILESCC(C)C(=O)Nc1cnn2c1NCCC2
InChIInChI=1S/C10H16N4O/c1-7(2)10(15)13-8-6-12-14-5-3-4-11-9(8)14/h6-7,11H,3-5H2,1-2H3,(H,13,15)
InChIKeyNKTGDTOICMPPOL-UHFFFAOYSA-N
XLogP1.29
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 107335226
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CID 108052620
CID 108052620
CID 114037921
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CID 56643115
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CID 13007222
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CID 21988397
CID 21988397

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide (CID 165445223) is 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide is CC(C)C(=O)Nc1cnn2c1NCCC2.
What is the InChIKey of 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide?
The InChIKey is NKTGDTOICMPPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7(2)10(15)13-8-6-12-14-5-3-4-11-9(8)14/h6-7,11H,3-5H2,1-2H3,(H,13,15).
What are the key properties of 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide?
2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide has a molecular weight of 208.26 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)propanamide is sourced from PubChem (CID 165445223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).