5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide

C16H24ClN3O — CID 114923849

IUPAC5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NC2CCC(CC)C2C)c(Cl)cn1
InChIInChI=1S/C16H24ClN3O/c1-4-11-6-7-14(10(11)3)20-16(21)12-8-15(18-5-2)19-9-13(12)17/h8-11,14H,4-7H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyZZOAFFZYYDHEMZ-UHFFFAOYSA-N
MW309.84 g/mol
LogP3.72
Rot. Bonds5

About 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide

5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide (PubChem CID 114923849) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide
PubChem CID114923849
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC Name5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NC2CCC(CC)C2C)c(Cl)cn1
InChIInChI=1S/C16H24ClN3O/c1-4-11-6-7-14(10(11)3)20-16(21)12-8-15(18-5-2)19-9-13(12)17/h8-11,14H,4-7H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyZZOAFFZYYDHEMZ-UHFFFAOYSA-N
XLogP3.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide (CID 114923849) is 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide is CCNc1cc(C(=O)NC2CCC(CC)C2C)c(Cl)cn1.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide?
The InChIKey is ZZOAFFZYYDHEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O/c1-4-11-6-7-14(10(11)3)20-16(21)12-8-15(18-5-2)19-9-13(12)17/h8-11,14H,4-7H2,1-3H3,(H,18,19)(H,20,21).
What are the key properties of 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide?
5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide has a molecular weight of 309.84 g/mol, XLogP of 3.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-(3-ethyl-2-methylcyclopentyl)pyridine-4-carboxamide is sourced from PubChem (CID 114923849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).