6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide

C20H21N7O2 — CID 165415283

IUPAC6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
SMILESCC(C)Oc1cccc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)n1
InChIInChI=1S/C20H21N7O2/c1-12(2)29-17-5-3-4-16(26-17)27-20(28)18-19(24-14-8-21-11-22-9-14)23-10-15(25-18)13-6-7-13/h3-5,8-13H,6-7H2,1-2H3,(H,23,24)(H,26,27,28)
InChIKeyPLPYNZZJTMKHCN-UHFFFAOYSA-N
MW391.44 g/mol
LogP3.32
Rot. Bonds7

About 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide

6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide (PubChem CID 165415283) has the molecular formula C20H21N7O2 and a molecular weight of 391.44 g/mol. Its IUPAC name is 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
PubChem CID165415283
Molecular FormulaC20H21N7O2
Molecular Weight391.44 g/mol
Exact Mass391.18
IUPAC Name6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
SMILESCC(C)Oc1cccc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)n1
InChIInChI=1S/C20H21N7O2/c1-12(2)29-17-5-3-4-16(26-17)27-20(28)18-19(24-14-8-21-11-22-9-14)23-10-15(25-18)13-6-7-13/h3-5,8-13H,6-7H2,1-2H3,(H,23,24)(H,26,27,28)
InChIKeyPLPYNZZJTMKHCN-UHFFFAOYSA-N
XLogP3.32
TPSA114.81 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.44
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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
3-amino-N-[3-(4-amino-4-methylpiperidin-1-yl)-2-pyridinyl]-6-(3-cyano-4-propan-2-yloxy-2-pyridinyl)pyrazine-2-carboxamide
CID 118873292
6-cyclopropyl-N-(3-ethoxyphenyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415117
6-cyclopropyl-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415184
6-cyclopropyl-N-(3-propan-2-yloxyphenyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415187
6-cyclopropyl-N-(2-ethoxy-4-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415207
6-cyclopropyl-N-(5-propan-2-yloxy-3-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 165415234

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide (CID 165415283) is 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide is CC(C)Oc1cccc(NC(=O)c2nc(C3CC3)cnc2Nc2cncnc2)n1.
What is the InChIKey of 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
The InChIKey is PLPYNZZJTMKHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7O2/c1-12(2)29-17-5-3-4-16(26-17)27-20(28)18-19(24-14-8-21-11-22-9-14)23-10-15(25-18)13-6-7-13/h3-5,8-13H,6-7H2,1-2H3,(H,23,24)(H,26,27,28).
What are the key properties of 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide?
6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide has a molecular weight of 391.44 g/mol, XLogP of 3.32, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(6-propan-2-yloxy-2-pyridinyl)-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 165415283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).