5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide

C15H17ClN4O — CID 114921592

IUPAC5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCCc2ccccn2)c(Cl)cn1
InChIInChI=1S/C15H17ClN4O/c1-2-17-14-9-12(13(16)10-20-14)15(21)19-8-6-11-5-3-4-7-18-11/h3-5,7,9-10H,2,6,8H2,1H3,(H,17,20)(H,19,21)
InChIKeyMBYYSNBWOMNWDP-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.53
Rot. Bonds6

About 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide

5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide (PubChem CID 114921592) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
PubChem CID114921592
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCCc2ccccn2)c(Cl)cn1
InChIInChI=1S/C15H17ClN4O/c1-2-17-14-9-12(13(16)10-20-14)15(21)19-8-6-11-5-3-4-7-18-11/h3-5,7,9-10H,2,6,8H2,1H3,(H,17,20)(H,19,21)
InChIKeyMBYYSNBWOMNWDP-UHFFFAOYSA-N
XLogP2.53
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-(ethylamino)-N-(2-phenylethyl)pyridine-4-carboxamide
CID 114921831
2,5-dichloro-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 114917187
5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide
CID 62171740
5-chloro-2-(ethylamino)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyridine-4-carboxamide
CID 106050087
2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 62173151
2-chloro-5-methylsulfanyl-N-(2-pyridin-2-ylethyl)benzamide
CID 4783071
5-chloro-2-(ethylamino)-N-(2-methylsulfinylethyl)pyridine-4-carboxamide
CID 114924532
N-(2-butoxyethyl)-5-chloro-2-(ethylamino)pyridine-4-carboxamide
CID 114923111
4-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 62172971
5-chloro-N-(2,3-dimethylbutyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923804
5-propyl-N-(2-pyridin-2-ylethyl)-1H-pyrazole-4-carboxamide
CID 74231466
2-(2-ethylphenyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 142054987

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide (CID 114921592) is 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide is CCNc1cc(C(=O)NCCc2ccccn2)c(Cl)cn1.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The InChIKey is MBYYSNBWOMNWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-2-17-14-9-12(13(16)10-20-14)15(21)19-8-6-11-5-3-4-7-18-11/h3-5,7,9-10H,2,6,8H2,1H3,(H,17,20)(H,19,21).
What are the key properties of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 2.53, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 114921592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).