N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide

C12H18N4O2 — CID 107374972

IUPACN-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)N(CCOC)C2CC2)cn1
InChIInChI=1S/C12H18N4O2/c1-13-11-8-14-10(7-15-11)12(17)16(5-6-18-2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,13,15)
InChIKeySOZGXADCBAIKKX-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.77
Rot. Bonds6

About N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide

N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide (PubChem CID 107374972) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide
PubChem CID107374972
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)N(CCOC)C2CC2)cn1
InChIInChI=1S/C12H18N4O2/c1-13-11-8-14-10(7-15-11)12(17)16(5-6-18-2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,13,15)
InChIKeySOZGXADCBAIKKX-UHFFFAOYSA-N
XLogP0.77
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide (CID 107374972) is N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide is CNc1cnc(C(=O)N(CCOC)C2CC2)cn1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide?
The InChIKey is SOZGXADCBAIKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-13-11-8-14-10(7-15-11)12(17)16(5-6-18-2)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,13,15).
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide?
N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-5-(methylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107374972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).