5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide

C13H18ClN3O — CID 62169291

IUPAC5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(C(=O)N(CC)C2CC2)cc1Cl
InChIInChI=1S/C13H18ClN3O/c1-3-15-12-11(14)7-9(8-16-12)13(18)17(4-2)10-5-6-10/h7-8,10H,3-6H2,1-2H3,(H,15,16)
InChIKeyICMNFOIJCYSSGV-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.79
Rot. Bonds5

About 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide

5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide (PubChem CID 62169291) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
PubChem CID62169291
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(C(=O)N(CC)C2CC2)cc1Cl
InChIInChI=1S/C13H18ClN3O/c1-3-15-12-11(14)7-9(8-16-12)13(18)17(4-2)10-5-6-10/h7-8,10H,3-6H2,1-2H3,(H,15,16)
InChIKeyICMNFOIJCYSSGV-UHFFFAOYSA-N
XLogP2.79
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-cyclopropyl-N-ethyl-6-(propylamino)pyridine-3-carboxamide
CID 62169292
5-chloro-N-cyclopropyl-N-(cyclopropylmethyl)-6-(ethylamino)pyridine-3-carboxamide
CID 64522048
6-amino-5-chloro-N-cyclopropyl-N-ethylpyridine-3-carboxamide
CID 62155621
5-chloro-N-cyclopropyl-6-hydrazinyl-N-propylpyridine-3-carboxamide
CID 62243745
5-chloro-6-(ethylamino)-N,N-bis(2-methylpropyl)pyridine-3-carboxamide
CID 62180091
5-chloro-N-cyclopropyl-6-(methylamino)-N-(2-methylpropyl)pyridine-3-carboxamide
CID 55047231
5-chloro-6-(ethylamino)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 62177921
5-chloro-6-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-3-carboxamide
CID 79311186
5-chloro-6-(ethylamino)-N-[(4-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 63499570
5-chloro-N-ethyl-6-(ethylamino)-N-(1-methoxypropan-2-yl)pyridine-3-carboxamide
CID 62180115
5-chloro-N-cyclopropyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 62238262
5-chloro-N-(2-cyanoethyl)-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 62170876

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide (CID 62169291) is 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide is CCNc1ncc(C(=O)N(CC)C2CC2)cc1Cl.
What is the InChIKey of 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide?
The InChIKey is ICMNFOIJCYSSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-3-15-12-11(14)7-9(8-16-12)13(18)17(4-2)10-5-6-10/h7-8,10H,3-6H2,1-2H3,(H,15,16).
What are the key properties of 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide?
5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide has a molecular weight of 267.76 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-N-ethyl-6-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62169291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).