6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

C19H22Cl2N4O3 — CID 58885848

IUPAC6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESNc1ncc(C(=O)NCCN2CCOCC2)cc1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C19H22Cl2N4O3/c20-15-2-1-3-16(21)14(15)12-28-17-10-13(11-24-18(17)22)19(26)23-4-5-25-6-8-27-9-7-25/h1-3,10-11H,4-9,12H2,(H2,22,24)(H,23,26)
InChIKeyANKSUGUVVZKVFB-UHFFFAOYSA-N
MW425.32 g/mol
LogP2.61
Rot. Bonds7

About 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (PubChem CID 58885848) has the molecular formula C19H22Cl2N4O3 and a molecular weight of 425.32 g/mol. Its IUPAC name is 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
PubChem CID58885848
Molecular FormulaC19H22Cl2N4O3
Molecular Weight425.32 g/mol
Exact Mass424.11
IUPAC Name6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESNc1ncc(C(=O)NCCN2CCOCC2)cc1OCc1c(Cl)cccc1Cl
InChIInChI=1S/C19H22Cl2N4O3/c20-15-2-1-3-16(21)14(15)12-28-17-10-13(11-24-18(17)22)19(26)23-4-5-25-6-8-27-9-7-25/h1-3,10-11H,4-9,12H2,(H2,22,24)(H,23,26)
InChIKeyANKSUGUVVZKVFB-UHFFFAOYSA-N
XLogP2.61
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.32
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

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Related Compounds

4-[6-amino-5-[[2-(trifluoromethyl)phenyl]methoxy]-3-pyridinyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 21111284
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
3-[5-amino-6-[2-(2,6-dichloro-3-fluorophenyl)ethoxy]pyrazin-2-yl]-N-(2-morpholin-4-ylethyl)benzamide
CID 91295817
5-chloro-6-(ethylamino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 62166235
3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 71690241
2-amino-5-chloro-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 114921931
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
5-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185766
6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-[8-(2-ethylbutyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]pyridine-3-carboxamide
CID 58886264
2-[4-[6-amino-5-[(2,6-dichlorophenyl)methoxy]pyridine-3-carbonyl]piperazin-1-yl]-1-piperidin-1-ylethanone
CID 58886146
3-[5-amino-6-[(2-chloro-3,6-difluorophenyl)methoxy]pyrazin-2-yl]-N-(3-morpholin-4-ylpropyl)benzamide
CID 21111126
6-[3-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyridine-3-carboxylic acid
CID 121495695

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (CID 58885848) is 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is Nc1ncc(C(=O)NCCN2CCOCC2)cc1OCc1c(Cl)cccc1Cl.
What is the InChIKey of 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The InChIKey is ANKSUGUVVZKVFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22Cl2N4O3/c20-15-2-1-3-16(21)14(15)12-28-17-10-13(11-24-18(17)22)19(26)23-4-5-25-6-8-27-9-7-25/h1-3,10-11H,4-9,12H2,(H2,22,24)(H,23,26).
What are the key properties of 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide has a molecular weight of 425.32 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-[(2,6-dichlorophenyl)methoxy]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 58885848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).