4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide

C12H23N3O3 — CID 83100709

IUPAC4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1C1CNCC1O
InChIInChI=1S/C12H23N3O3/c1-8(2)14-12(17)10-7-18-4-3-15(10)9-5-13-6-11(9)16/h8-11,13,16H,3-7H2,1-2H3,(H,14,17)
InChIKeyIDPDMDRJNIQEQH-UHFFFAOYSA-N
MW257.33 g/mol
LogP-1.46
Rot. Bonds3

About 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide

4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide (PubChem CID 83100709) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide
PubChem CID83100709
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1C1CNCC1O
InChIInChI=1S/C12H23N3O3/c1-8(2)14-12(17)10-7-18-4-3-15(10)9-5-13-6-11(9)16/h8-11,13,16H,3-7H2,1-2H3,(H,14,17)
InChIKeyIDPDMDRJNIQEQH-UHFFFAOYSA-N
XLogP-1.46
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 5-1.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(propan-2-ylcarbamoyl)morpholin-4-yl]cyclobutane-1-carboxylic acid
CID 83103874
4-(azetidine-3-carbonyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83098043
N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 118118161
(3S)-N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 140959044
3-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 83106391
N-ethyl-4-(4-methylsulfanylpyrrolidin-3-yl)morpholine-3-carboxamide
CID 83099882
N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
CID 112573894
4-(2-piperidin-3-ylacetyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83099192
potassium trifluoro-[[3-(propan-2-ylcarbamoyl)morpholin-4-yl]methyl]boranuide
CID 83104637
4-(5-methylpiperazine-2-carbonyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83101075
5-[3-(propan-2-ylcarbamoyl)morpholin-4-yl]pyridine-2-carboxylic acid
CID 104638974
(2R)-2-[[3-(propan-2-ylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83104584

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The IUPAC name of 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide (CID 83100709) is 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The canonical SMILES for 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide is CC(C)NC(=O)C1COCCN1C1CNCC1O.
What is the InChIKey of 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide?
The InChIKey is IDPDMDRJNIQEQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-8(2)14-12(17)10-7-18-4-3-15(10)9-5-13-6-11(9)16/h8-11,13,16H,3-7H2,1-2H3,(H,14,17).
What are the key properties of 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide?
4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide has a molecular weight of 257.33 g/mol, XLogP of -1.46, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypyrrolidin-3-yl)-N-propan-2-ylmorpholine-3-carboxamide is sourced from PubChem (CID 83100709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).