N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide

C20H25ClN4O2 — CID 133302708

IUPACN-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide
SMILESCC(CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)N1CCOCC1C
InChIInChI=1S/C20H25ClN4O2/c1-14(25-8-9-27-13-15(25)2)11-22-19-7-6-16(12-23-19)20(26)24-18-5-3-4-17(21)10-18/h3-7,10,12,14-15H,8-9,11,13H2,1-2H3,(H,22,23)(H,24,26)
InChIKeyGSGJDPOTNAOWTD-UHFFFAOYSA-N
MW388.90 g/mol
LogP3.51
Rot. Bonds6

About N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide

N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide (PubChem CID 133302708) has the molecular formula C20H25ClN4O2 and a molecular weight of 388.90 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide
PubChem CID133302708
Molecular FormulaC20H25ClN4O2
Molecular Weight388.90 g/mol
Exact Mass388.17
IUPAC NameN-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide
SMILESCC(CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)N1CCOCC1C
InChIInChI=1S/C20H25ClN4O2/c1-14(25-8-9-27-13-15(25)2)11-22-19-7-6-16(12-23-19)20(26)24-18-5-3-4-17(21)10-18/h3-7,10,12,14-15H,8-9,11,13H2,1-2H3,(H,22,23)(H,24,26)
InChIKeyGSGJDPOTNAOWTD-UHFFFAOYSA-N
XLogP3.51
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.90
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-[(3R)-3-methylmorpholin-4-yl]propyl]pyridin-2-amine
CID 129427083
N-[(2S)-2-[(3S)-3-methylmorpholin-4-yl]propyl]pyridin-2-amine
CID 96527242
6-[(4-carbamoyloxan-4-yl)methylamino]-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 133430584
N-(3-chlorophenyl)-6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156937
N-(3-chlorophenyl)-6-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155987
N-(3-chlorophenyl)-6-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156799
N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156138
N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158234
N-(3-chlorophenyl)-6-(2,6-dioxaspiro[4.5]decan-9-ylamino)pyridine-3-carboxamide
CID 127729044
N-(3-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160796
6-(4-acetylanilino)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109163447
6-(4-acetylpiperazin-1-yl)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109155130

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide (CID 133302708) is N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide is CC(CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)N1CCOCC1C.
What is the InChIKey of N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide?
The InChIKey is GSGJDPOTNAOWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25ClN4O2/c1-14(25-8-9-27-13-15(25)2)11-22-19-7-6-16(12-23-19)20(26)24-18-5-3-4-17(21)10-18/h3-7,10,12,14-15H,8-9,11,13H2,1-2H3,(H,22,23)(H,24,26).
What are the key properties of N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide?
N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide has a molecular weight of 388.90 g/mol, XLogP of 3.51, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-[2-(3-methylmorpholin-4-yl)propylamino]pyridine-3-carboxamide is sourced from PubChem (CID 133302708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).