N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride

C18H26ClN3O3 — CID 119304348

IUPACN-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
SMILESCc1c(NC(=O)C2CCNCC2)cccc1C(=O)N1CCOCC1.Cl
InChIInChI=1S/C18H25N3O3.ClH/c1-13-15(18(23)21-9-11-24-12-10-21)3-2-4-16(13)20-17(22)14-5-7-19-8-6-14;/h2-4,14,19H,5-12H2,1H3,(H,20,22);1H
InChIKeyMIJNSBSILCLTAX-UHFFFAOYSA-N
MW367.88 g/mol
LogP1.83
Rot. Bonds3

About N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride

N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119304348) has the molecular formula C18H26ClN3O3 and a molecular weight of 367.88 g/mol. Its IUPAC name is N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
PubChem CID119304348
Molecular FormulaC18H26ClN3O3
Molecular Weight367.88 g/mol
Exact Mass367.17
IUPAC NameN-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
SMILESCc1c(NC(=O)C2CCNCC2)cccc1C(=O)N1CCOCC1.Cl
InChIInChI=1S/C18H25N3O3.ClH/c1-13-15(18(23)21-9-11-24-12-10-21)3-2-4-16(13)20-17(22)14-5-7-19-8-6-14;/h2-4,14,19H,5-12H2,1H3,(H,20,22);1H
InChIKeyMIJNSBSILCLTAX-UHFFFAOYSA-N
XLogP1.83
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.88
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
CID 171362080
N-[3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119283240
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119261898
2-cyclopropyl-N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]propanamide
CID 126786282
4-[[2-methyl-3-(morpholine-4-carbonyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122077590
N-[3-methyl-2-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide
CID 119285186
N-(3-fluoro-2-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119281807
N-(2-morpholin-4-ylphenyl)piperidine-4-carboxamide
CID 43708109
N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119750611
(E)-3-(2,6-dichlorophenyl)-N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]prop-2-enamide
CID 94642545
N-[2-(2-morpholin-4-yl-2-oxoethoxy)phenyl]piperidine-4-carboxamide
CID 119341376
N-(2-morpholin-4-yl-3-pyridinyl)piperidine-4-carboxamide
CID 119845829

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride (CID 119304348) is N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride is Cc1c(NC(=O)C2CCNCC2)cccc1C(=O)N1CCOCC1.Cl.
What is the InChIKey of N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is MIJNSBSILCLTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3.ClH/c1-13-15(18(23)21-9-11-24-12-10-21)3-2-4-16(13)20-17(22)14-5-7-19-8-6-14;/h2-4,14,19H,5-12H2,1H3,(H,20,22);1H.
What are the key properties of N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride?
N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 367.88 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119304348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).