5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide

C14H22ClN3O — CID 62179174

IUPAC5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide
SMILESCCCC(CC)NC(=O)c1cnc(NCC)c(Cl)c1
InChIInChI=1S/C14H22ClN3O/c1-4-7-11(5-2)18-14(19)10-8-12(15)13(16-6-3)17-9-10/h8-9,11H,4-7H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyANKIWFCMPWIPTB-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.48
Rot. Bonds7

About 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide

5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide (PubChem CID 62179174) has the molecular formula C14H22ClN3O and a molecular weight of 283.80 g/mol. Its IUPAC name is 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide
PubChem CID62179174
Molecular FormulaC14H22ClN3O
Molecular Weight283.80 g/mol
Exact Mass283.15
IUPAC Name5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide
SMILESCCCC(CC)NC(=O)c1cnc(NCC)c(Cl)c1
InChIInChI=1S/C14H22ClN3O/c1-4-7-11(5-2)18-14(19)10-8-12(15)13(16-6-3)17-9-10/h8-9,11H,4-7H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyANKIWFCMPWIPTB-UHFFFAOYSA-N
XLogP3.48
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-6-hydrazinyl-N-pentan-3-ylpyridine-3-carboxamide
CID 62247358
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CID 62186092
5,6-dichloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-3-carboxamide
CID 93040790
3-chloro-N-hexan-3-yl-4-hydroxybenzamide
CID 62046987
5-chloro-6-(ethylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
CID 55071772
5-chloro-6-(propylamino)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-3-carboxamide
CID 106283572
N-(2-butoxyethyl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
CID 62176364
5-chloro-6-(ethylamino)-N-[(4-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 63499570
5-chloro-N-[1-(dimethylamino)propan-2-yl]-6-(propylamino)pyridine-3-carboxamide
CID 82949525
5-chloro-6-(ethylamino)-N,N-bis(2-methylpropyl)pyridine-3-carboxamide
CID 62180091
5-chloro-6-(ethylamino)-N-thiophen-3-ylpyridine-3-carboxamide
CID 66353786
5-chloro-6-(ethylamino)-N-(4-hydroxycyclohexyl)pyridine-3-carboxamide
CID 62171335

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide (CID 62179174) is 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide is CCCC(CC)NC(=O)c1cnc(NCC)c(Cl)c1.
What is the InChIKey of 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide?
The InChIKey is ANKIWFCMPWIPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3O/c1-4-7-11(5-2)18-14(19)10-8-12(15)13(16-6-3)17-9-10/h8-9,11H,4-7H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide?
5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide has a molecular weight of 283.80 g/mol, XLogP of 3.48, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 62179174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).