(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane

C9H16 — CID 59524466

IUPAC(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane
SMILESC[C@@H]1CC1CC1C[C@@H]1C
InChIInChI=1S/C9H16/c1-6-3-8(6)5-9-4-7(9)2/h6-9H,3-5H2,1-2H3/t6-,7+,8?,9?
InChIKeyWWXGBMZROYHRPZ-QPIHLSAKSA-N
MW124.23 g/mol
LogP2.69
Rot. Bonds2

About (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane

(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane (PubChem CID 59524466) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane.

Molecular Properties

Compound Name(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane
PubChem CID59524466
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane
SMILESC[C@@H]1CC1CC1C[C@@H]1C
InChIInChI=1S/C9H16/c1-6-3-8(6)5-9-4-7(9)2/h6-9H,3-5H2,1-2H3/t6-,7+,8?,9?
InChIKeyWWXGBMZROYHRPZ-QPIHLSAKSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(cyclopropylmethyl)-2-[(2-methylcyclopropyl)methyl]cyclopropane
CID 123233514
trans-(1R,2S)-1-methyl-2-[2-[(1R,2S)-2-methylcyclopropyl]ethyl]cyclopropane
CID 23638911
2-methyl-3-[(2-methylcyclopropyl)methyl]bicyclo[2.2.0]hexane
CID 91468181
[(1S,2S)-2-methylcyclopropyl]methanol
CID 7869082
2,4,6-trimethyl-7-[(2-methylcyclopropyl)methyl]bicyclo[3.2.0]heptane
CID 90697583
4,6-bis[(4-hydroxy-2,5-dimethylcyclohexyl)methyl]-2-methylcyclohexane-1,3-diol
CID 140638045
1,2,5-trimethyl-3-[(2,3,5-trimethylcyclohexyl)methyl]cyclohexane
CID 15751895
ethane;1-ethyl-2-methylcyclopropane;propane
CID 142903717
2,4-bis[(4-hydroxy-2,5-dimethylcyclohexyl)methyl]-3,6-dimethylcyclohexan-1-ol
CID 140638061
2-[(4-hydroxy-2,5-dimethylcyclohexyl)methyl]-4-[[4-hydroxy-3-[(4-hydroxy-2,5-dimethylcyclohexyl)methyl]-5-methylcyclohexyl]methyl]-6-methylcyclohexan-1-ol
CID 140524947
2-[(2S)-2-methylcyclopropyl]ethanamine
CID 154557552
1-methyl-2-[(2-methylcyclopentyl)methyl]cyclopentane
CID 148598305

Frequently Asked Questions

What is the IUPAC name of (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane?
The IUPAC name of (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane (CID 59524466) is (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane.
What is the SMILES notation for (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane?
The canonical SMILES for (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane is C[C@@H]1CC1CC1C[C@@H]1C.
What is the InChIKey of (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane?
The InChIKey is WWXGBMZROYHRPZ-QPIHLSAKSA-N. The full InChI is InChI=1S/C9H16/c1-6-3-8(6)5-9-4-7(9)2/h6-9H,3-5H2,1-2H3/t6-,7+,8?,9?.
What are the key properties of (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane?
(1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane has a molecular weight of 124.23 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-methyl-2-[[(2R)-2-methylcyclopropyl]methyl]cyclopropane is sourced from PubChem (CID 59524466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).