N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide

C14H17N5O — CID 50962699

IUPACN-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide
SMILESCc1cnn(C(C)C2CC2)c1NC(=O)c1cnccn1
InChIInChI=1S/C14H17N5O/c1-9-7-17-19(10(2)11-3-4-11)13(9)18-14(20)12-8-15-5-6-16-12/h5-8,10-11H,3-4H2,1-2H3,(H,18,20)
InChIKeyIGIWGEVNXNKGED-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.20
Rot. Bonds4

About N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide

N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide (PubChem CID 50962699) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide
PubChem CID50962699
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide
SMILESCc1cnn(C(C)C2CC2)c1NC(=O)c1cnccn1
InChIInChI=1S/C14H17N5O/c1-9-7-17-19(10(2)11-3-4-11)13(9)18-14(20)12-8-15-5-6-16-12/h5-8,10-11H,3-4H2,1-2H3,(H,18,20)
InChIKeyIGIWGEVNXNKGED-UHFFFAOYSA-N
XLogP2.20
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide (CID 50962699) is N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide is Cc1cnn(C(C)C2CC2)c1NC(=O)c1cnccn1.
What is the InChIKey of N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide?
The InChIKey is IGIWGEVNXNKGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-9-7-17-19(10(2)11-3-4-11)13(9)18-14(20)12-8-15-5-6-16-12/h5-8,10-11H,3-4H2,1-2H3,(H,18,20).
What are the key properties of N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide?
N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-cyclopropylethyl)-4-methylpyrazol-5-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 50962699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).