1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride

C16H30ClN3O3 — CID 119763218

IUPAC1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride
SMILESCCCC(C)NC(=O)C1CCCN(C(=O)C2COCCN2)C1.Cl
InChIInChI=1S/C16H29N3O3.ClH/c1-3-5-12(2)18-15(20)13-6-4-8-19(10-13)16(21)14-11-22-9-7-17-14;/h12-14,17H,3-11H2,1-2H3,(H,18,20);1H
InChIKeyMSPHJCYLDFPYRJ-UHFFFAOYSA-N
MW347.89 g/mol
LogP0.94
Rot. Bonds5

About 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride

1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119763218) has the molecular formula C16H30ClN3O3 and a molecular weight of 347.89 g/mol. Its IUPAC name is 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride
PubChem CID119763218
Molecular FormulaC16H30ClN3O3
Molecular Weight347.89 g/mol
Exact Mass347.20
IUPAC Name1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride
SMILESCCCC(C)NC(=O)C1CCCN(C(=O)C2COCCN2)C1.Cl
InChIInChI=1S/C16H29N3O3.ClH/c1-3-5-12(2)18-15(20)13-6-4-8-19(10-13)16(21)14-11-22-9-7-17-14;/h12-14,17H,3-11H2,1-2H3,(H,18,20);1H
InChIKeyMSPHJCYLDFPYRJ-UHFFFAOYSA-N
XLogP0.94
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.89
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(morpholine-3-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone;hydrochloride
CID 119700492
N-propan-2-yl-1-[(2R)-pyrrolidine-2-carbonyl]piperidine-3-carboxamide
CID 53015059
cyclohexyl-[4-(morpholine-3-carbonyl)piperazin-1-yl]methanone;hydrochloride
CID 119755465
(3-ethylpyrrolidin-1-yl)-morpholin-3-ylmethanone
CID 115740814
[3-(azepan-1-ylmethyl)piperidin-1-yl]-morpholin-3-ylmethanone
CID 119875712
morpholin-3-yl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103812428
1-(3-aminocyclopentanecarbonyl)-N-pentan-2-ylpiperidine-3-carboxamide
CID 119763227
1-(1-methylsulfonylpiperidine-4-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide
CID 47088084
N-butyl-1-(piperidine-2-carbonyl)piperidine-3-carboxamide
CID 119311468
N-pentan-2-ylcyclohexanecarboxamide
CID 19916603
1-(3-aminopropanoyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride
CID 119311679
N-(4-hydroxybutan-2-yl)morpholine-3-carboxamide
CID 83177558

Frequently Asked Questions

What is the IUPAC name of 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride (CID 119763218) is 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride is CCCC(C)NC(=O)C1CCCN(C(=O)C2COCCN2)C1.Cl.
What is the InChIKey of 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is MSPHJCYLDFPYRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3.ClH/c1-3-5-12(2)18-15(20)13-6-4-8-19(10-13)16(21)14-11-22-9-7-17-14;/h12-14,17H,3-11H2,1-2H3,(H,18,20);1H.
What are the key properties of 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride?
1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 347.89 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(morpholine-3-carbonyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119763218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).