4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide

C15H24N2O3 — CID 49418648

IUPAC4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide
SMILESCC(C)=CC1C(C(=O)N2CCOC(C(N)=O)C2)C1(C)C
InChIInChI=1S/C15H24N2O3/c1-9(2)7-10-12(15(10,3)4)14(19)17-5-6-20-11(8-17)13(16)18/h7,10-12H,5-6,8H2,1-4H3,(H2,16,18)
InChIKeyZVDRVZOVBAMGOI-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.94
Rot. Bonds3

About 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide

4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide (PubChem CID 49418648) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide
PubChem CID49418648
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide
SMILESCC(C)=CC1C(C(=O)N2CCOC(C(N)=O)C2)C1(C)C
InChIInChI=1S/C15H24N2O3/c1-9(2)7-10-12(15(10,3)4)14(19)17-5-6-20-11(8-17)13(16)18/h7,10-12H,5-6,8H2,1-4H3,(H2,16,18)
InChIKeyZVDRVZOVBAMGOI-UHFFFAOYSA-N
XLogP0.94
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(6R)-4-[(2,6-dimethylcyclohex-2-en-1-yl)methyl]-6-methylmorpholine-2-carboxamide
CID 91651123
2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]cyclopropane-1-carboxamide
CID 47016973
cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]cyclopropane-1-carboxamide
CID 39485008
cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]cyclopropane-1-carboxamide
CID 39485009
[2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]-morpholin-4-ylmethanone
CID 42924029
[2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 47014950
(2S)-4-[(1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide
CID 94371199
(2S)-4-[(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide
CID 94371201
(2S)-4-[[(1R,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]morpholine-2-carboxamide
CID 99790031
(2S)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]morpholine-2-carboxamide
CID 99790033
(2S)-4-[[(1R,6R)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-N-methylmorpholine-2-carboxamide
CID 99790058
(2S)-4-[[(1R,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-N-methylmorpholine-2-carboxamide
CID 99790059

Frequently Asked Questions

What is the IUPAC name of 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide?
The IUPAC name of 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide (CID 49418648) is 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide.
What is the SMILES notation for 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide?
The canonical SMILES for 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide is CC(C)=CC1C(C(=O)N2CCOC(C(N)=O)C2)C1(C)C.
What is the InChIKey of 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide?
The InChIKey is ZVDRVZOVBAMGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-9(2)7-10-12(15(10,3)4)14(19)17-5-6-20-11(8-17)13(16)18/h7,10-12H,5-6,8H2,1-4H3,(H2,16,18).
What are the key properties of 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide?
4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]morpholine-2-carboxamide is sourced from PubChem (CID 49418648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).