N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide

C16H29N3O3 — CID 119886734

IUPACN-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCOCC1)C1CNCCO1
InChIInChI=1S/C16H29N3O3/c20-15(14-12-17-6-11-22-14)18-13-16(4-9-21-10-5-16)19-7-2-1-3-8-19/h14,17H,1-13H2,(H,18,20)
InChIKeyMCTMGDWTGVSELW-UHFFFAOYSA-N
MW311.43 g/mol
LogP0.13
Rot. Bonds4

About N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide

N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide (PubChem CID 119886734) has the molecular formula C16H29N3O3 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide
PubChem CID119886734
Molecular FormulaC16H29N3O3
Molecular Weight311.43 g/mol
Exact Mass311.22
IUPAC NameN-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCOCC1)C1CNCCO1
InChIInChI=1S/C16H29N3O3/c20-15(14-12-17-6-11-22-14)18-13-16(4-9-21-10-5-16)19-7-2-1-3-8-19/h14,17H,1-13H2,(H,18,20)
InChIKeyMCTMGDWTGVSELW-UHFFFAOYSA-N
XLogP0.13
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-piperidin-1-yloxan-4-yl)methyl]pyrrolidine-3-carboxamide
CID 119886746
2-morpholin-2-yl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 119682320
N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrrolidine-3-carboxamide
CID 63006010
1-[(morpholine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
CID 115445861
N-[(1-ethylcyclobutyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 119782167
N-(3-oxo-3-piperidin-1-ylpropyl)morpholine-2-carboxamide
CID 112701632
N-[(4-piperidin-1-yloxan-4-yl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119886702
1-amino-N-[(4-piperidin-1-yloxan-4-yl)methyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119886673
N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]morpholine-2-carboxamide
CID 65119743
N-(5-piperidin-1-ylpentyl)morpholine-2-carboxamide;dihydrochloride
CID 119885469
N-[(1-methyl-4-piperidin-1-ylpiperidin-4-yl)methyl]pyrrolidine-3-carboxamide;trihydrochloride
CID 119903563
3-[(2S)-oxolan-2-yl]-N-[(4-piperidin-1-yloxan-4-yl)methyl]propanamide
CID 95619752

Frequently Asked Questions

What is the IUPAC name of N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide?
The IUPAC name of N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide (CID 119886734) is N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide?
The canonical SMILES for N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide is O=C(NCC1(N2CCCCC2)CCOCC1)C1CNCCO1.
What is the InChIKey of N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide?
The InChIKey is MCTMGDWTGVSELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3/c20-15(14-12-17-6-11-22-14)18-13-16(4-9-21-10-5-16)19-7-2-1-3-8-19/h14,17H,1-13H2,(H,18,20).
What are the key properties of N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide?
N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide has a molecular weight of 311.43 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-piperidin-1-yloxan-4-yl)methyl]morpholine-2-carboxamide is sourced from PubChem (CID 119886734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).