1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide

C14H24N2O3 — CID 109131415

IUPAC1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
SMILESCC(C)CNC(=O)C1CC1C(=O)NCC1CCCO1
InChIInChI=1S/C14H24N2O3/c1-9(2)7-15-13(17)11-6-12(11)14(18)16-8-10-4-3-5-19-10/h9-12H,3-8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyDPSHFDQXUCEBSD-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.69
Rot. Bonds6

About 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide

1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109131415) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
PubChem CID109131415
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
SMILESCC(C)CNC(=O)C1CC1C(=O)NCC1CCCO1
InChIInChI=1S/C14H24N2O3/c1-9(2)7-15-13(17)11-6-12(11)14(18)16-8-10-4-3-5-19-10/h9-12H,3-8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyDPSHFDQXUCEBSD-UHFFFAOYSA-N
XLogP0.69
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(2-methylpropyl)-1-N-(oxolan-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109145227
2-amino-N-(oxolan-2-ylmethyl)cyclopropane-1-carboxamide
CID 114995836
2-N-(oxolan-2-ylmethyl)-1-N,1-N-dipropylcyclopropane-1,2-dicarboxamide
CID 109133520
3-methyl-N-(oxolan-2-ylmethyl)butanamide
CID 3509797
2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide
CID 40531863
1-N-(4-acetylphenyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
CID 109133579
2-(oxolan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 3119934
5-N-(2-methylpropyl)-3-N-(oxolan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109102110
(2S)-2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 61145996
2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 24697469
1-N-(3-methylphenyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
CID 109133527
1-N-(2,6-dichlorophenyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide
CID 109133618

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide (CID 109131415) is 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide is CC(C)CNC(=O)C1CC1C(=O)NCC1CCCO1.
What is the InChIKey of 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is DPSHFDQXUCEBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-9(2)7-15-13(17)11-6-12(11)14(18)16-8-10-4-3-5-19-10/h9-12H,3-8H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide?
1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 268.36 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-methylpropyl)-2-N-(oxolan-2-ylmethyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109131415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).