1-(2-bromopropyl)-2-methylcyclopropane

C7H13Br — CID 146693854

IUPAC1-(2-bromopropyl)-2-methylcyclopropane
SMILESCC(Br)CC1CC1C
InChIInChI=1S/C7H13Br/c1-5-3-7(5)4-6(2)8/h5-7H,3-4H2,1-2H3
InChIKeyQLRTZHJZEVWTIB-UHFFFAOYSA-N
MW177.08 g/mol
LogP2.82
Rot. Bonds2

About 1-(2-bromopropyl)-2-methylcyclopropane

1-(2-bromopropyl)-2-methylcyclopropane (PubChem CID 146693854) has the molecular formula C7H13Br and a molecular weight of 177.08 g/mol. Its IUPAC name is 1-(2-bromopropyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(2-bromopropyl)-2-methylcyclopropane
PubChem CID146693854
Molecular FormulaC7H13Br
Molecular Weight177.08 g/mol
Exact Mass176.02
IUPAC Name1-(2-bromopropyl)-2-methylcyclopropane
SMILESCC(Br)CC1CC1C
InChIInChI=1S/C7H13Br/c1-5-3-7(5)4-6(2)8/h5-7H,3-4H2,1-2H3
InChIKeyQLRTZHJZEVWTIB-UHFFFAOYSA-N
XLogP2.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.08
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1-methyl-2-(2-methylbutyl)cyclopropane
CID 91076617
N-methyl-1-(2-methylcyclopropyl)propan-2-amine
CID 91182461
2,6-dimethyl-3,7-bis(2-methylpropyl)-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene
CID 91321156
3-methyl-4-(2-methylcyclopropyl)butan-2-one
CID 91382640
1-ethyl-2-methylcyclopropane;2-methylpropane
CID 155747981
1-(2,4-dimethylheptyl)-2-methylcyclopropane
CID 123484269
1-(3,4-diethyl-2,5-dimethylhexyl)-2-methylcyclopropane
CID 123891563
(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane
CID 59524466
trans-(1R,2S)-1-methyl-2-[2-[(1R,2S)-2-methylcyclopropyl]ethyl]cyclopropane
CID 23638911
(1R,2R,4R)-1,4-dimethyl-2-(2-methylpropyl)cyclohexane
CID 55253031
N-[(2-methylcyclopropyl)methyl]ethanimine
CID 148555664

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromopropyl)-2-methylcyclopropane?
The IUPAC name of 1-(2-bromopropyl)-2-methylcyclopropane (CID 146693854) is 1-(2-bromopropyl)-2-methylcyclopropane.
What is the SMILES notation for 1-(2-bromopropyl)-2-methylcyclopropane?
The canonical SMILES for 1-(2-bromopropyl)-2-methylcyclopropane is CC(Br)CC1CC1C.
What is the InChIKey of 1-(2-bromopropyl)-2-methylcyclopropane?
The InChIKey is QLRTZHJZEVWTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13Br/c1-5-3-7(5)4-6(2)8/h5-7H,3-4H2,1-2H3.
What are the key properties of 1-(2-bromopropyl)-2-methylcyclopropane?
1-(2-bromopropyl)-2-methylcyclopropane has a molecular weight of 177.08 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromopropyl)-2-methylcyclopropane is sourced from PubChem (CID 146693854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).