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

C15H16ClN3O2 — CID 81237548

IUPACN-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1cc(OC)ccc1Cl
InChIInChI=1S/C15H16ClN3O2/c1-3-18-13-6-7-17-9-11(13)15(20)19-14-8-10(21-2)4-5-12(14)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyIRUSMBCHWAVISX-UHFFFAOYSA-N
MW305.77 g/mol
LogP3.43
Rot. Bonds5

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

N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide (PubChem CID 81237548) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.77 g/mol. Its IUPAC name is N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
PubChem CID81237548
Molecular FormulaC15H16ClN3O2
Molecular Weight305.77 g/mol
Exact Mass305.09
IUPAC NameN-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1cc(OC)ccc1Cl
InChIInChI=1S/C15H16ClN3O2/c1-3-18-13-6-7-17-9-11(13)15(20)19-14-8-10(21-2)4-5-12(14)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyIRUSMBCHWAVISX-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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Related Compounds

N-(5-chloro-2-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81237296
N-(3-bromo-4-chlorophenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81245404
N-(2,5-dichlorophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 81237097
4-(ethylamino)-N-(4-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 81241556
N-(2-bromo-5-methoxyphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245977
N-(3-chloro-2-pyridinyl)-4-(ethylamino)pyridine-3-carboxamide
CID 103094868
N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81237400
N-(2-bromophenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236092
4-(ethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 81236067
4-(ethylamino)-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 81236730
N-(5-bromo-2-methylphenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81242957
N-(2-chloro-5-methoxyphenyl)-2,5-dihydroxybenzamide
CID 107722765

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide (CID 81237548) is N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide is CCNc1ccncc1C(=O)Nc1cc(OC)ccc1Cl.
What is the InChIKey of N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The InChIKey is IRUSMBCHWAVISX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c1-3-18-13-6-7-17-9-11(13)15(20)19-14-8-10(21-2)4-5-12(14)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
N-(2-chloro-5-methoxyphenyl)-4-(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-(2-chloro-5-methoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81237548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).