N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

C12H14N4O — CID 110090595

IUPACN-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NCC2CC2)n2nccc2n1
InChIInChI=1S/C12H14N4O/c1-8-6-10(12(17)13-7-9-2-3-9)16-11(15-8)4-5-14-16/h4-6,9H,2-3,7H2,1H3,(H,13,17)
InChIKeyPJHKDVXQSMZJFM-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.18
Rot. Bonds3

About N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 110090595) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID110090595
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NCC2CC2)n2nccc2n1
InChIInChI=1S/C12H14N4O/c1-8-6-10(12(17)13-7-9-2-3-9)16-11(15-8)4-5-14-16/h4-6,9H,2-3,7H2,1H3,(H,13,17)
InChIKeyPJHKDVXQSMZJFM-UHFFFAOYSA-N
XLogP1.18
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (CID 110090595) is N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is Cc1cc(C(=O)NCC2CC2)n2nccc2n1.
What is the InChIKey of N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is PJHKDVXQSMZJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-6-10(12(17)13-7-9-2-3-9)16-11(15-8)4-5-14-16/h4-6,9H,2-3,7H2,1H3,(H,13,17).
What are the key properties of N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 110090595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).