(1R)-1,2-dimethylcyclobutan-1-amine

C6H13N — CID 147198625

IUPAC(1R)-1,2-dimethylcyclobutan-1-amine
SMILESCC1CC[C@@]1(C)N
InChIInChI=1S/C6H13N/c1-5-3-4-6(5,2)7/h5H,3-4,7H2,1-2H3/t5?,6-/m1/s1
InChIKeyCCWKQPXFMZCOTR-PRJDIBJQSA-N
MW99.18 g/mol
LogP1.13
Rot. Bonds

About (1R)-1,2-dimethylcyclobutan-1-amine

(1R)-1,2-dimethylcyclobutan-1-amine (PubChem CID 147198625) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is (1R)-1,2-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name(1R)-1,2-dimethylcyclobutan-1-amine
PubChem CID147198625
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name(1R)-1,2-dimethylcyclobutan-1-amine
SMILESCC1CC[C@@]1(C)N
InChIInChI=1S/C6H13N/c1-5-3-4-6(5,2)7/h5H,3-4,7H2,1-2H3/t5?,6-/m1/s1
InChIKeyCCWKQPXFMZCOTR-PRJDIBJQSA-N
XLogP1.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-dimethylcyclobutan-1-amine;formic acid
CID 175124192
1,2-dimethylcyclopentan-1-amine;hydrochloride
CID 146050243
trans-(1R,2S)-1-methylcyclobutane-1,2-diamine
CID 12699189
trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine
CID 55289923
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
carbonic acid;1,2-dimethylcyclohexan-1-amine
CID 173050882
1,4-dimethylcyclohexane-1,2-diamine
CID 91102899
carbamic acid;1,2-dimethylcyclohexan-1-amine
CID 175425918
CID 18798545
CID 18798545
3-amino-2,3-dimethylcyclopentane-1-carboxylic acid
CID 45122086
2-methyl-1-propan-2-ylcyclobutan-1-amine
CID 57373673
(2R)-2-methylbicyclo[3.1.1]heptan-2-amine
CID 55290522

Frequently Asked Questions

What is the IUPAC name of (1R)-1,2-dimethylcyclobutan-1-amine?
The IUPAC name of (1R)-1,2-dimethylcyclobutan-1-amine (CID 147198625) is (1R)-1,2-dimethylcyclobutan-1-amine.
What is the SMILES notation for (1R)-1,2-dimethylcyclobutan-1-amine?
The canonical SMILES for (1R)-1,2-dimethylcyclobutan-1-amine is CC1CC[C@@]1(C)N.
What is the InChIKey of (1R)-1,2-dimethylcyclobutan-1-amine?
The InChIKey is CCWKQPXFMZCOTR-PRJDIBJQSA-N. The full InChI is InChI=1S/C6H13N/c1-5-3-4-6(5,2)7/h5H,3-4,7H2,1-2H3/t5?,6-/m1/s1.
What are the key properties of (1R)-1,2-dimethylcyclobutan-1-amine?
(1R)-1,2-dimethylcyclobutan-1-amine has a molecular weight of 99.18 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,2-dimethylcyclobutan-1-amine is sourced from PubChem (CID 147198625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).