6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide

C19H19N7O2 — CID 165415207

IUPAC6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
SMILESCCOc1cc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)ccn1
InChIInChI=1S/C19H19N7O2/c1-2-28-16-7-13(5-6-22-16)25-19(27)17-18(24-14-8-20-11-21-9-14)23-10-15(26-17)12-3-4-12/h5-12H,2-4H2,1H3,(H,23,24)(H,22,25,27)
InChIKeyCAKWCEAEXGNKFU-UHFFFAOYSA-N
MW377.41 g/mol
LogP2.93
Rot. Bonds7

About 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide

6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide (PubChem CID 165415207) has the molecular formula C19H19N7O2 and a molecular weight of 377.41 g/mol. Its IUPAC name is 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
PubChem CID165415207
Molecular FormulaC19H19N7O2
Molecular Weight377.41 g/mol
Exact Mass377.16
IUPAC Name6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
SMILESCCOc1cc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)ccn1
InChIInChI=1S/C19H19N7O2/c1-2-28-16-7-13(5-6-22-16)25-19(27)17-18(24-14-8-20-11-21-9-14)23-10-15(26-17)12-3-4-12/h5-12H,2-4H2,1H3,(H,23,24)(H,22,25,27)
InChIKeyCAKWCEAEXGNKFU-UHFFFAOYSA-N
XLogP2.93
TPSA114.81 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.41
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

6-cyclopropyl-3-(pyrimidin-5-ylamino)-N-[3-(2,2,2-trifluoroethoxy)phenyl]pyrazine-2-carboxamide
CID 165415171
6-cyclopropyl-N-[5-(difluoromethoxy)-3-pyridinyl]-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415257
6-cyclopropyl-3-(pyrimidin-5-ylamino)-N-[3-(trifluoromethoxy)phenyl]pyrazine-2-carboxamide
CID 165415264
3-amino-N-[3-(4-amino-4-methylpiperidin-1-yl)-2-pyridinyl]-6-(3-fluoro-4-methoxy-2-pyridinyl)pyrazine-2-carboxamide
CID 118873199
3-amino-N-[3-(4-amino-4-methylpiperidin-1-yl)pyridin-2-yl]-6-[4-ethoxy-3-(trifluoromethyl)pyridin-2-yl]pyrazine-2-carboxamide
CID 118873244
3-amino-N-[3-(4-amino-4-methylpiperidin-1-yl)-2-pyridinyl]-6-(3-cyano-4-cyclopropyloxy-2-pyridinyl)pyrazine-2-carboxamide
CID 118873276
6-cyclopropyl-N-(3-ethoxyphenyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415117
6-cyclopropyl-N-(3-propan-2-yloxyphenyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415187
6-cyclopropyl-N-(5-propan-2-yloxy-3-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415234
6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415283
6-cyclopropyl-N-(6-methoxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415354
N-(6-methoxy-3-pyridinyl)-2-(pyridin-4-ylamino)pyrimidine-4-carboxamide
CID 164614928

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide (CID 165415207) is 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide is CCOc1cc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)ccn1.
What is the InChIKey of 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The InChIKey is CAKWCEAEXGNKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7O2/c1-2-28-16-7-13(5-6-22-16)25-19(27)17-18(24-14-8-20-11-21-9-14)23-10-15(26-17)12-3-4-12/h5-12H,2-4H2,1H3,(H,23,24)(H,22,25,27).
What are the key properties of 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide has a molecular weight of 377.41 g/mol, XLogP of 2.93, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 165415207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).