5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide

C14H15ClN4O2 — CID 107249436

IUPAC5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H15ClN4O2/c1-9(2)21-14-10(4-3-5-16-14)6-19-13(20)11-7-18-12(15)8-17-11/h3-5,7-9H,6H2,1-2H3,(H,19,20)
InChIKeyBPXCLOQYUUTGCV-UHFFFAOYSA-N
MW306.75 g/mol
LogP2.24
Rot. Bonds5

About 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide

5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide (PubChem CID 107249436) has the molecular formula C14H15ClN4O2 and a molecular weight of 306.75 g/mol. Its IUPAC name is 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
PubChem CID107249436
Molecular FormulaC14H15ClN4O2
Molecular Weight306.75 g/mol
Exact Mass306.09
IUPAC Name5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H15ClN4O2/c1-9(2)21-14-10(4-3-5-16-14)6-19-13(20)11-7-18-12(15)8-17-11/h3-5,7-9H,6H2,1-2H3,(H,19,20)
InChIKeyBPXCLOQYUUTGCV-UHFFFAOYSA-N
XLogP2.24
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]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

4-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 81229055
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyrazole-4-carboxamide
CID 60975328
5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 63860474
5-(2-methylpropyl)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyrazole-3-carboxamide
CID 55742343
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
methyl 2-[(2-propan-2-yloxy-3-pyridinyl)methylamino]acetate
CID 61375172
2,3-dimethyl-4-oxo-4-[(2-propan-2-yloxy-3-pyridinyl)methylamino]but-2-enoic acid
CID 76992706
1-amino-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropane-1-carboxamide
CID 65464946
(2R)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 94171586
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-indazole-7-carboxamide
CID 47057623
3-amino-2,2-dimethyl-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]propanamide
CID 115426650
5-chloro-N-[(4-propan-2-ylphenyl)methyl]pyrazine-2-carboxamide
CID 107244703

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide (CID 107249436) is 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide is CC(C)Oc1ncccc1CNC(=O)c1cnc(Cl)cn1.
What is the InChIKey of 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide?
The InChIKey is BPXCLOQYUUTGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN4O2/c1-9(2)21-14-10(4-3-5-16-14)6-19-13(20)11-7-18-12(15)8-17-11/h3-5,7-9H,6H2,1-2H3,(H,19,20).
What are the key properties of 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide?
5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 107249436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).