1-methyl-2-propa-1,2-dienylcyclopropane

C7H10 — CID 123896728

IUPAC1-methyl-2-propa-1,2-dienylcyclopropane
SMILESC=C=CC1CC1C
InChIInChI=1S/C7H10/c1-3-4-7-5-6(7)2/h4,6-7H,1,5H2,2H3
InChIKeyMKBGTTSKVGUVDL-UHFFFAOYSA-N
MW94.16 g/mol
LogP1.98
Rot. Bonds1

About 1-methyl-2-propa-1,2-dienylcyclopropane

1-methyl-2-propa-1,2-dienylcyclopropane (PubChem CID 123896728) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is 1-methyl-2-propa-1,2-dienylcyclopropane.

Molecular Properties

Compound Name1-methyl-2-propa-1,2-dienylcyclopropane
PubChem CID123896728
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Name1-methyl-2-propa-1,2-dienylcyclopropane
SMILESC=C=CC1CC1C
InChIInChI=1S/C7H10/c1-3-4-7-5-6(7)2/h4,6-7H,1,5H2,2H3
InChIKeyMKBGTTSKVGUVDL-UHFFFAOYSA-N
XLogP1.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

cis-(1S,2S)-1-hexa-1,2,5-trienyl-2-methylcyclopropane
CID 101148448
(2-propa-1,2-dienylcyclopropyl)methanol
CID 123155641
cis-(1R,2S)-1-(2-deuterioethenyl)-2-methylcyclopropane
CID 16698025
1,2,4-tris(ethenyl)-5-methylcyclohexane
CID 91133944
1,1,2-trimethyl-6-propa-1,2-dienylsilinane
CID 174897712
2,3-dimethylcyclobutane-1-carbaldehyde
CID 54074602
[(2S)-2-methylcyclopropyl]methanimine
CID 147736127
N-[(1S)-2-methylcyclopropyl]ethenimine
CID 149214769
1-[(2R,3S)-3-propa-1,2-dienyl-1,2,3,4-tetrahydronaphthalen-2-yl]ethanone
CID 10013424
N-buta-1,2,3-trienyl-2-methylcyclopropan-1-amine
CID 163712422
1,1-dichloro-2-propa-1,2-dienylcyclopropane
CID 134977576
1-buta-2,3-dienyl-3-ethyl-4-methylpyrrolidine
CID 138507775

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-propa-1,2-dienylcyclopropane?
The IUPAC name of 1-methyl-2-propa-1,2-dienylcyclopropane (CID 123896728) is 1-methyl-2-propa-1,2-dienylcyclopropane.
What is the SMILES notation for 1-methyl-2-propa-1,2-dienylcyclopropane?
The canonical SMILES for 1-methyl-2-propa-1,2-dienylcyclopropane is C=C=CC1CC1C.
What is the InChIKey of 1-methyl-2-propa-1,2-dienylcyclopropane?
The InChIKey is MKBGTTSKVGUVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10/c1-3-4-7-5-6(7)2/h4,6-7H,1,5H2,2H3.
What are the key properties of 1-methyl-2-propa-1,2-dienylcyclopropane?
1-methyl-2-propa-1,2-dienylcyclopropane has a molecular weight of 94.16 g/mol, XLogP of 1.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-propa-1,2-dienylcyclopropane is sourced from PubChem (CID 123896728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).