N-propan-2-ylmorpholine-4-carboxamide

C8H16N2O2 — CID 3411412

IUPACN-propan-2-ylmorpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-7(2)9-8(11)10-3-5-12-6-4-10/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyVGEHUCHOIFQYFR-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.44
Rot. Bonds1

About N-propan-2-ylmorpholine-4-carboxamide

N-propan-2-ylmorpholine-4-carboxamide (PubChem CID 3411412) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-propan-2-ylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-propan-2-ylmorpholine-4-carboxamide
PubChem CID3411412
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-propan-2-ylmorpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-7(2)9-8(11)10-3-5-12-6-4-10/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyVGEHUCHOIFQYFR-UHFFFAOYSA-N
XLogP0.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-morpholin-4-ylethyl)-N-propan-2-ylpiperazine-1-carboxamide
CID 113073717
N-propan-2-ylazetidine-1-carboxamide
CID 126972093
N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-1-carboxamide
CID 116657750
3-methyl-2-(morpholine-4-carbonylamino)butanoyl iodide
CID 129144228
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181
N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 111444624
N-(1-amino-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 79155057
N-(4-methylsulfanylbutan-2-yl)morpholine-4-carboxamide
CID 115640219
N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
CID 115665185
methyl (2S)-3-methyl-2-(morpholine-4-carbonylamino)butanoate
CID 940643
1-(1-morpholin-4-yl-1-oxopropan-2-yl)-3-propan-2-ylurea
CID 115620431
N-propan-2-yl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 47236079

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylmorpholine-4-carboxamide?
The IUPAC name of N-propan-2-ylmorpholine-4-carboxamide (CID 3411412) is N-propan-2-ylmorpholine-4-carboxamide.
What is the SMILES notation for N-propan-2-ylmorpholine-4-carboxamide?
The canonical SMILES for N-propan-2-ylmorpholine-4-carboxamide is CC(C)NC(=O)N1CCOCC1.
What is the InChIKey of N-propan-2-ylmorpholine-4-carboxamide?
The InChIKey is VGEHUCHOIFQYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-7(2)9-8(11)10-3-5-12-6-4-10/h7H,3-6H2,1-2H3,(H,9,11).
What are the key properties of N-propan-2-ylmorpholine-4-carboxamide?
N-propan-2-ylmorpholine-4-carboxamide has a molecular weight of 172.23 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylmorpholine-4-carboxamide is sourced from PubChem (CID 3411412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).