N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride

C17H21Cl2N3O3 — CID 119864469

IUPACN-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride
SMILESCc1cc(NC(=O)C2COCCN2)ccc1Oc1cccnc1.Cl.Cl
InChIInChI=1S/C17H19N3O3.2ClH/c1-12-9-13(20-17(21)15-11-22-8-7-19-15)4-5-16(12)23-14-3-2-6-18-10-14;;/h2-6,9-10,15,19H,7-8,11H2,1H3,(H,20,21);2*1H
InChIKeyIAYGFHAHXLEPRU-UHFFFAOYSA-N
MW386.28 g/mol
LogP2.95
Rot. Bonds4

About N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride

N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride (PubChem CID 119864469) has the molecular formula C17H21Cl2N3O3 and a molecular weight of 386.28 g/mol. Its IUPAC name is N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride
PubChem CID119864469
Molecular FormulaC17H21Cl2N3O3
Molecular Weight386.28 g/mol
Exact Mass385.10
IUPAC NameN-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride
SMILESCc1cc(NC(=O)C2COCCN2)ccc1Oc1cccnc1.Cl.Cl
InChIInChI=1S/C17H19N3O3.2ClH/c1-12-9-13(20-17(21)15-11-22-8-7-19-15)4-5-16(12)23-14-3-2-6-18-10-14;;/h2-6,9-10,15,19H,7-8,11H2,1H3,(H,20,21);2*1H
InChIKeyIAYGFHAHXLEPRU-UHFFFAOYSA-N
XLogP2.95
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.28
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(3-methyl-4-pyridin-3-yloxyphenyl)pyrrolidine-2-carboxamide
CID 100663215
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-[3-methyl-4-(2,2,2-trifluoroethoxy)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119794822
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-[4-methyl-3-[(4-methyl-2-pyridinyl)oxy]phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119891518
N-(4-phenoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 75422319
N-(3-pyrazin-2-yloxyphenyl)morpholine-3-carboxamide
CID 119720300
(2S,5R)-5-(aminomethyl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)oxolane-2-carboxamide;dihydrochloride
CID 120799083
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[6-(2,3-dimethylphenoxy)-3-pyridinyl]morpholine-3-carboxamide;dihydrochloride
CID 119888475
cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide
CID 97003815
N-(3-phenoxyphenyl)morpholine-3-carboxamide
CID 75422303

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride?
The IUPAC name of N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride (CID 119864469) is N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride is Cc1cc(NC(=O)C2COCCN2)ccc1Oc1cccnc1.Cl.Cl.
What is the InChIKey of N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride?
The InChIKey is IAYGFHAHXLEPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3.2ClH/c1-12-9-13(20-17(21)15-11-22-8-7-19-15)4-5-16(12)23-14-3-2-6-18-10-14;;/h2-6,9-10,15,19H,7-8,11H2,1H3,(H,20,21);2*1H.
What are the key properties of N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride?
N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride has a molecular weight of 386.28 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119864469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).