5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide

C12H14ClN5O2 — CID 133294145

IUPAC5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide
SMILESCCc1noc(CN(C)c2ncc(C(N)=O)cc2Cl)n1
InChIInChI=1S/C12H14ClN5O2/c1-3-9-16-10(20-17-9)6-18(2)12-8(13)4-7(5-15-12)11(14)19/h4-5H,3,6H2,1-2H3,(H2,14,19)
InChIKeyDRRFJWMFRJBEMW-UHFFFAOYSA-N
MW295.73 g/mol
LogP1.42
Rot. Bonds5

About 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide

5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide (PubChem CID 133294145) has the molecular formula C12H14ClN5O2 and a molecular weight of 295.73 g/mol. Its IUPAC name is 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide
PubChem CID133294145
Molecular FormulaC12H14ClN5O2
Molecular Weight295.73 g/mol
Exact Mass295.08
IUPAC Name5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide
SMILESCCc1noc(CN(C)c2ncc(C(N)=O)cc2Cl)n1
InChIInChI=1S/C12H14ClN5O2/c1-3-9-16-10(20-17-9)6-18(2)12-8(13)4-7(5-15-12)11(14)19/h4-5H,3,6H2,1-2H3,(H2,14,19)
InChIKeyDRRFJWMFRJBEMW-UHFFFAOYSA-N
XLogP1.42
TPSA98.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-6-[cyclopentylmethyl(methyl)amino]pyridine-3-carboxamide
CID 75418381
5-chloro-6-[[3-(dimethylamino)phenyl]methyl-methylamino]pyridine-3-carboxamide
CID 133385930
6-[2-(4-bromophenyl)ethyl-methylamino]-5-chloropyridine-3-carboxamide
CID 133292141
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]acetic acid
CID 43442230
5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide
CID 133356764
methyl 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]-2-methylpropanoate
CID 60971190
5-(3,4-dichlorophenyl)-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methylthiophene-2-carboxamide
CID 86888039
2-[4-(4-chlorobenzoyl)phenoxy]-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methylacetamide
CID 56510085
N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 51134825
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]propanoic acid
CID 62637255
1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-1-methyl-3-phenylurea
CID 51108291
(1S,2R)-4,6-dichloro-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]-2,3-dihydro-1H-inden-2-ol
CID 124850604

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide (CID 133294145) is 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide is CCc1noc(CN(C)c2ncc(C(N)=O)cc2Cl)n1.
What is the InChIKey of 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide?
The InChIKey is DRRFJWMFRJBEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN5O2/c1-3-9-16-10(20-17-9)6-18(2)12-8(13)4-7(5-15-12)11(14)19/h4-5H,3,6H2,1-2H3,(H2,14,19).
What are the key properties of 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide?
5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide has a molecular weight of 295.73 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 133294145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).