2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide

C10H15NO2 — CID 130688581

IUPAC2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1[C@H]2COC[C@H]12
InChIInChI=1S/C10H15NO2/c1-5-2-6(5)10(12)11-9-7-3-13-4-8(7)9/h5-9H,2-4H2,1H3,(H,11,12)/t5?,6?,7-,8-/m0/s1
InChIKeyCCYPPPRFHHONNZ-GHNGIAPOSA-N
MW181.23 g/mol
LogP0.40
Rot. Bonds2

About 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide

2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide (PubChem CID 130688581) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide
PubChem CID130688581
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NC1[C@H]2COC[C@H]12
InChIInChI=1S/C10H15NO2/c1-5-2-6(5)10(12)11-9-7-3-13-4-8(7)9/h5-9H,2-4H2,1H3,(H,11,12)/t5?,6?,7-,8-/m0/s1
InChIKeyCCYPPPRFHHONNZ-GHNGIAPOSA-N
XLogP0.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromooxolan-3-yl)-2-methylcyclopropane-1-carboxamide
CID 130654779
trans-(1S,2S)-2-methyl-N-[(3S)-oxan-3-yl]cyclopropane-1-carboxamide
CID 131113536
2-methyl-N-(3-methylcyclobutyl)cyclopropane-1-carboxamide
CID 130668952
trans-(1S,2S)-N-[(1R,2S)-2-cyclopropylcyclopropyl]-2-methylcyclopropane-1-carboxamide
CID 131165871
trans-(1R,2R)-2-methyl-N-(2-methyloxolan-3-yl)cyclopropane-1-carboxamide
CID 130637471
2-methyl-N-(oxetan-3-yl)cyclopentane-1-carboxamide
CID 107180280
2-methyl-N-(2-methylcyclohexyl)cyclopropane-1-carboxamide
CID 4084655
2-methyl-N-(3-methylcyclopentyl)cyclopropane-1-carboxamide
CID 114549485
cis-(1S,3R)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 97030816
(1S,5R)-N-methyl-3-oxabicyclo[3.1.0]hexane-6-carboxamide
CID 67591291
N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylcyclopropane-1-carboxamide
CID 114630806
trans-(1S,2S)-N-[(1S,2S)-2-(difluoromethyl)cyclopropyl]-2-methylcyclopropane-1-carboxamide
CID 130892896

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide (CID 130688581) is 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide is CC1CC1C(=O)NC1[C@H]2COC[C@H]12.
What is the InChIKey of 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide?
The InChIKey is CCYPPPRFHHONNZ-GHNGIAPOSA-N. The full InChI is InChI=1S/C10H15NO2/c1-5-2-6(5)10(12)11-9-7-3-13-4-8(7)9/h5-9H,2-4H2,1H3,(H,11,12)/t5?,6?,7-,8-/m0/s1.
What are the key properties of 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide?
2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1S,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 130688581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).