4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide

C11H15N3O3 — CID 83102195

IUPAC4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide
SMILESN#CC1(C(=O)N2CCOCC2C(N)=O)CCC1
InChIInChI=1S/C11H15N3O3/c12-7-11(2-1-3-11)10(16)14-4-5-17-6-8(14)9(13)15/h8H,1-6H2,(H2,13,15)
InChIKeyCDDAMHPQFZAANI-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.61
Rot. Bonds2

About 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide

4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide (PubChem CID 83102195) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide
PubChem CID83102195
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide
SMILESN#CC1(C(=O)N2CCOCC2C(N)=O)CCC1
InChIInChI=1S/C11H15N3O3/c12-7-11(2-1-3-11)10(16)14-4-5-17-6-8(14)9(13)15/h8H,1-6H2,(H2,13,15)
InChIKeyCDDAMHPQFZAANI-UHFFFAOYSA-N
XLogP-0.61
TPSA96.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxylate
CID 104774578
4-(1-cyanocyclopentanecarbonyl)-N-propylmorpholine-3-carboxamide
CID 83096887
1-(1-cyanocyclopropanecarbonyl)pyrrolidine-2-carboxamide
CID 80598716
3-methyl-1-(3-methylmorpholine-4-carbonyl)cyclobutane-1-carbonitrile
CID 80599333
4-(1-carbamothioyl-3-methylcyclobutanecarbonyl)morpholine-3-carboxamide
CID 83102673
4-[2-[1-(aminomethyl)cyclohexyl]acetyl]morpholine-3-carboxamide
CID 104678604
1-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carbonyl)cyclohexane-1-carbonitrile
CID 61461468
4-(3-propylpiperidine-3-carbonyl)morpholine-3-carboxamide
CID 83102514
4-(cyanomethyl)morpholine-3-carboxamide
CID 83092724
4-(2-aminopropanoyl)morpholine-3-carboxamide
CID 83101341
1-[3-[4-(cyclobutylamino)pyrimidin-2-yl]morpholine-4-carbonyl]cyclopentane-1-carbonitrile
CID 131687139
1-(2-propan-2-ylpyrrolidine-1-carbonyl)cyclobutane-1-carbonitrile
CID 80592692

Frequently Asked Questions

What is the IUPAC name of 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide?
The IUPAC name of 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide (CID 83102195) is 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide?
The canonical SMILES for 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide is N#CC1(C(=O)N2CCOCC2C(N)=O)CCC1.
What is the InChIKey of 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide?
The InChIKey is CDDAMHPQFZAANI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c12-7-11(2-1-3-11)10(16)14-4-5-17-6-8(14)9(13)15/h8H,1-6H2,(H2,13,15).
What are the key properties of 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide?
4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyanocyclobutanecarbonyl)morpholine-3-carboxamide is sourced from PubChem (CID 83102195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).