5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide

C13H14ClN5O2 — CID 67980338

IUPAC5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide
SMILESC[C@@H](O)CNc1cncc(-c2cc(C(N)=O)ncc2Cl)n1
InChIInChI=1S/C13H14ClN5O2/c1-7(20)3-18-12-6-16-5-11(19-12)8-2-10(13(15)21)17-4-9(8)14/h2,4-7,20H,3H2,1H3,(H2,15,21)(H,18,19)/t7-/m1/s1
InChIKeyKZQMWKIWRNLSFV-SSDOTTSWSA-N
MW307.74 g/mol
LogP1.08
Rot. Bonds5

About 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide

5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide (PubChem CID 67980338) has the molecular formula C13H14ClN5O2 and a molecular weight of 307.74 g/mol. Its IUPAC name is 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide
PubChem CID67980338
Molecular FormulaC13H14ClN5O2
Molecular Weight307.74 g/mol
Exact Mass307.08
IUPAC Name5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide
SMILESC[C@@H](O)CNc1cncc(-c2cc(C(N)=O)ncc2Cl)n1
InChIInChI=1S/C13H14ClN5O2/c1-7(20)3-18-12-6-16-5-11(19-12)8-2-10(13(15)21)17-4-9(8)14/h2,4-7,20H,3H2,1H3,(H2,15,21)(H,18,19)/t7-/m1/s1
InChIKeyKZQMWKIWRNLSFV-SSDOTTSWSA-N
XLogP1.08
TPSA114.02 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.74
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-[[6-(ethylamino)pyrazin-2-yl]amino]propan-2-ol
CID 78990450
1-[(3-chloro-1,2,4-triazin-5-yl)amino]propan-2-ol
CID 82237449
4-[6-(oxan-4-ylmethylamino)pyrazin-2-yl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 67980208
6-chloro-4-(2-hydroxypropylamino)pyridine-3-carboxamide
CID 146277774
2-(2-hydroxypropylamino)pyridine-4-carboxamide
CID 130671464
6-(2-amino-5-chloro-4-pyridinyl)-N-[(4-fluorophenyl)methyl]pyrazin-2-amine
CID 67980486
(2S)-1-[(4-amino-6-chloro-2-pyridinyl)amino]propan-2-ol
CID 126987917
6-[2-(dimethylamino)ethylamino]pyrazine-2-carboxamide
CID 133447093
6-[2-(1,3-benzothiazol-2-yl)propylamino]pyrazine-2-carboxamide
CID 75469836
(2R)-1-[(2,6-dichloropyrimidin-4-yl)amino]propan-2-ol
CID 90456586
6-(2-amino-5-chloro-4-pyridinyl)-N-(oxan-4-ylmethyl)pyrazin-2-amine
CID 67033343
3-[(6,7-dichloroquinoxalin-2-yl)amino]-2-hydroxy-N-methylpropanamide
CID 119035417

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide?
The IUPAC name of 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide (CID 67980338) is 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide is C[C@@H](O)CNc1cncc(-c2cc(C(N)=O)ncc2Cl)n1.
What is the InChIKey of 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide?
The InChIKey is KZQMWKIWRNLSFV-SSDOTTSWSA-N. The full InChI is InChI=1S/C13H14ClN5O2/c1-7(20)3-18-12-6-16-5-11(19-12)8-2-10(13(15)21)17-4-9(8)14/h2,4-7,20H,3H2,1H3,(H2,15,21)(H,18,19)/t7-/m1/s1.
What are the key properties of 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide?
5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide has a molecular weight of 307.74 g/mol, XLogP of 1.08, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-[6-[[(2R)-2-hydroxypropyl]amino]pyrazin-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 67980338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).