4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile

C10H14N2O2 — CID 78945771

IUPAC4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile
SMILESCC1CC1C(=O)N1CCOC(C#N)C1
InChIInChI=1S/C10H14N2O2/c1-7-4-9(7)10(13)12-2-3-14-8(5-11)6-12/h7-9H,2-4,6H2,1H3
InChIKeyAFANAQHKYQMMAR-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.39
Rot. Bonds1

About 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile

4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile (PubChem CID 78945771) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile.

Molecular Properties

Compound Name4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile
PubChem CID78945771
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile
SMILESCC1CC1C(=O)N1CCOC(C#N)C1
InChIInChI=1S/C10H14N2O2/c1-7-4-9(7)10(13)12-2-3-14-8(5-11)6-12/h7-9H,2-4,6H2,1H3
InChIKeyAFANAQHKYQMMAR-UHFFFAOYSA-N
XLogP0.39
TPSA53.33 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cycloheptanecarbonyl)morpholine-2-carbonitrile
CID 78945818
4-(tricyclo[3.2.1.02,4]octane-3-carbonyl)morpholine-2-carbonitrile
CID 103761814
[2-(hydroxymethyl)morpholin-4-yl]-(2-methylcyclopropyl)methanone
CID 81208013
4-(4-aminocyclohexanecarbonyl)morpholine-2-carbonitrile
CID 79674039
4-(2-cyanopropanoyl)morpholine-2-carbonitrile
CID 78996355
propan-2-yl 2-cyanomorpholine-4-carboxylate
CID 79674867
2-cyano-N-propan-2-ylmorpholine-4-carboxamide
CID 78946088
N-tert-butyl-2-cyanomorpholine-4-carboxamide
CID 79674612
4-(2-methylfuran-3-carbonyl)morpholine-2-carbonitrile
CID 78945652
4-[(2S)-2-amino-3-methylbutanoyl]morpholine-2-carbonitrile
CID 79681377
4-(3-amino-2,2,3-trimethylbutanoyl)morpholine-2-carbonitrile
CID 79674055
1-(2-cyanomorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid
CID 107071765

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile?
The IUPAC name of 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile (CID 78945771) is 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile.
What is the SMILES notation for 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile?
The canonical SMILES for 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile is CC1CC1C(=O)N1CCOC(C#N)C1.
What is the InChIKey of 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile?
The InChIKey is AFANAQHKYQMMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-4-9(7)10(13)12-2-3-14-8(5-11)6-12/h7-9H,2-4,6H2,1H3.
What are the key properties of 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile?
4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile has a molecular weight of 194.23 g/mol, XLogP of 0.39, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylcyclopropanecarbonyl)morpholine-2-carbonitrile is sourced from PubChem (CID 78945771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).