N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide

C15H27N3O5 — CID 162967431

IUPACN-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide
SMILESO=C(NCC1OCC(NC2CCOCC2)C1O)N1CCOCC1
InChIInChI=1S/C15H27N3O5/c19-14-12(17-11-1-5-21-6-2-11)10-23-13(14)9-16-15(20)18-3-7-22-8-4-18/h11-14,17,19H,1-10H2,(H,16,20)
InChIKeyFXGXAZWYLCFEJX-UHFFFAOYSA-N
MW329.40 g/mol
LogP-1.07
Rot. Bonds4

About N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide

N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide (PubChem CID 162967431) has the molecular formula C15H27N3O5 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide
PubChem CID162967431
Molecular FormulaC15H27N3O5
Molecular Weight329.40 g/mol
Exact Mass329.20
IUPAC NameN-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide
SMILESO=C(NCC1OCC(NC2CCOCC2)C1O)N1CCOCC1
InChIInChI=1S/C15H27N3O5/c19-14-12(17-11-1-5-21-6-2-11)10-23-13(14)9-16-15(20)18-3-7-22-8-4-18/h11-14,17,19H,1-10H2,(H,16,20)
InChIKeyFXGXAZWYLCFEJX-UHFFFAOYSA-N
XLogP-1.07
TPSA92.29 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[(2R,3S,4R)-3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]pyridine-4-carboxamide
CID 75536789
N-[[(2R,3S,4R)-3-hydroxy-4-[(4-methoxyphenyl)methylamino]oxolan-2-yl]methyl]morpholine-4-carboxamide
CID 75536753
N-[[4-[(1-acetylpiperidin-4-yl)amino]-3-hydroxyoxolan-2-yl]methyl]benzamide
CID 162789752
1-[[(2R,3S,4R)-4-(cyclohexylamino)-3-hydroxyoxolan-2-yl]methyl]-3-propan-2-ylurea
CID 75367101
N-[(3S,4R,5S)-5-[(4,4-difluoropiperidin-1-yl)methyl]-4-hydroxyoxolan-3-yl]morpholine-4-carboxamide
CID 125417214
N-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-ylmethyl)morpholine-4-carboxamide
CID 115608175
N-[[(2R,3S,4R)-3-hydroxy-4-(piperidin-4-ylamino)oxolan-2-yl]methyl]benzamide
CID 75536616
N-[[(2R,3S,4R)-4-[(4,4-difluorocyclohexyl)amino]-3-hydroxyoxolan-2-yl]methyl]-3,3-dimethylbutanamide
CID 75536517
N-(3-methyl-2-oxobutyl)morpholine-4-carboxamide
CID 79152408
4-(morpholine-4-carbonyl)-N-(piperidin-4-ylmethyl)piperazine-1-carboxamide
CID 167899614
N-[[3-hydroxy-4-(propan-2-ylamino)oxolan-2-yl]methyl]cyclopropanecarboxamide
CID 162789996
methyl 4-(oxan-4-ylmethylcarbamoyl)piperazine-1-carboxylate
CID 108913044

Frequently Asked Questions

What is the IUPAC name of N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide?
The IUPAC name of N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide (CID 162967431) is N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide?
The canonical SMILES for N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide is O=C(NCC1OCC(NC2CCOCC2)C1O)N1CCOCC1.
What is the InChIKey of N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide?
The InChIKey is FXGXAZWYLCFEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O5/c19-14-12(17-11-1-5-21-6-2-11)10-23-13(14)9-16-15(20)18-3-7-22-8-4-18/h11-14,17,19H,1-10H2,(H,16,20).
What are the key properties of N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide?
N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide has a molecular weight of 329.40 g/mol, XLogP of -1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-hydroxy-4-(oxan-4-ylamino)oxolan-2-yl]methyl]morpholine-4-carboxamide is sourced from PubChem (CID 162967431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).