N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide

C15H16ClN3O2 — CID 62171907

IUPACN-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)ccc2OC)cn1
InChIInChI=1S/C15H16ClN3O2/c1-3-17-14-7-4-10(9-18-14)15(20)19-12-8-11(16)5-6-13(12)21-2/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyDUJPHXPHADPQQX-UHFFFAOYSA-N
MW305.77 g/mol
LogP3.43
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide

N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide (PubChem CID 62171907) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.77 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
PubChem CID62171907
Molecular FormulaC15H16ClN3O2
Molecular Weight305.77 g/mol
Exact Mass305.09
IUPAC NameN-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)ccc2OC)cn1
InChIInChI=1S/C15H16ClN3O2/c1-3-17-14-7-4-10(9-18-14)15(20)19-12-8-11(16)5-6-13(12)21-2/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyDUJPHXPHADPQQX-UHFFFAOYSA-N
XLogP3.43
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.77
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide (CID 62171907) is N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide is CCNc1ccc(C(=O)Nc2cc(Cl)ccc2OC)cn1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide?
The InChIKey is DUJPHXPHADPQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c1-3-17-14-7-4-10(9-18-14)15(20)19-12-8-11(16)5-6-13(12)21-2/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide has a molecular weight of 305.77 g/mol, XLogP of 3.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62171907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).