N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide

C17H19ClN4O2 — CID 67984187

IUPACN-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide
SMILESCC1(c2cccc(NC(=O)c3ccc(Cl)cn3)c2)CNCC(N)O1
InChIInChI=1S/C17H19ClN4O2/c1-17(10-20-9-15(19)24-17)11-3-2-4-13(7-11)22-16(23)14-6-5-12(18)8-21-14/h2-8,15,20H,9-10,19H2,1H3,(H,22,23)
InChIKeyOPUSJJMMMFRDHP-UHFFFAOYSA-N
MW346.82 g/mol
LogP2.11
Rot. Bonds3

About N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide

N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide (PubChem CID 67984187) has the molecular formula C17H19ClN4O2 and a molecular weight of 346.82 g/mol. Its IUPAC name is N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide
PubChem CID67984187
Molecular FormulaC17H19ClN4O2
Molecular Weight346.82 g/mol
Exact Mass346.12
IUPAC NameN-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide
SMILESCC1(c2cccc(NC(=O)c3ccc(Cl)cn3)c2)CNCC(N)O1
InChIInChI=1S/C17H19ClN4O2/c1-17(10-20-9-15(19)24-17)11-3-2-4-13(7-11)22-16(23)14-6-5-12(18)8-21-14/h2-8,15,20H,9-10,19H2,1H3,(H,22,23)
InChIKeyOPUSJJMMMFRDHP-UHFFFAOYSA-N
XLogP2.11
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.82
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[(3R)-5-amino-3-methyl-2,6-dihydro-1,4-oxazin-3-yl]phenyl]-5-chloropyridine-2-carboxamide
CID 50991585
N-[3-[(4S)-2-amino-4-methyl-6-oxo-1,5-dihydropyrimidin-4-yl]phenyl]-5-chloropyridine-2-carboxamide
CID 59570586
N-[3-[(4S)-6-amino-4-methyl-7H-pyrazolo[1,5-a]pyrazin-4-yl]phenyl]-5-chloropyridine-2-carboxamide
CID 56948644
6-[3-[(3-methoxyquinolin-8-yl)amino]phenyl]-6-methylmorpholin-2-amine
CID 70558068
N-[3-[(4aR,7aR)-2-amino-4a,5,6,7-tetrahydro-4H-cyclopenta[d][1,3]thiazin-7a-yl]phenyl]-5-chloropyridine-2-carboxamide
CID 66860495
N-[3-[(8aS)-2-amino-4a,5,7,8-tetrahydro-4H-pyrano[3,4-e][1,3]thiazin-8a-yl]phenyl]-5-chloropyridine-2-carboxamide
CID 66847791
5-chloro-N-(3-iodo-4-methylphenyl)pyridine-2-carboxamide
CID 113238388
N-[3-(6-amino-2-cyclopropylmorpholin-2-yl)-4-fluorophenyl]-5-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 66968744
5-chloro-N-[3-(N-hydroxy-C-methylcarbonimidoyl)phenyl]pyridine-2-carboxamide
CID 77037502
N-[3-(5-amino-3-methyl-2,6-dihydro-1,4-oxazin-3-yl)phenyl]-5-methylpyridine-2-carboxamide
CID 50914251
5-chloro-N-(2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide
CID 167928774
N-(5-chloro-2-pyridinyl)-3-[(3-methylpyrrolidin-3-yl)carbamoylamino]benzamide
CID 166243490

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide?
The IUPAC name of N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide (CID 67984187) is N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide.
What is the SMILES notation for N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide?
The canonical SMILES for N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide is CC1(c2cccc(NC(=O)c3ccc(Cl)cn3)c2)CNCC(N)O1.
What is the InChIKey of N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide?
The InChIKey is OPUSJJMMMFRDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN4O2/c1-17(10-20-9-15(19)24-17)11-3-2-4-13(7-11)22-16(23)14-6-5-12(18)8-21-14/h2-8,15,20H,9-10,19H2,1H3,(H,22,23).
What are the key properties of N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide?
N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide has a molecular weight of 346.82 g/mol, XLogP of 2.11, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-amino-2-methylmorpholin-2-yl)phenyl]-5-chloropyridine-2-carboxamide is sourced from PubChem (CID 67984187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).