2-methylbicyclo[2.2.0]hexan-2-amine

C7H13N — CID 123842739

IUPAC2-methylbicyclo[2.2.0]hexan-2-amine
SMILESCC1(N)CC2CCC21
InChIInChI=1S/C7H13N/c1-7(8)4-5-2-3-6(5)7/h5-6H,2-4,8H2,1H3
InChIKeyMLWRZECVIYBMLR-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.13
Rot. Bonds

About 2-methylbicyclo[2.2.0]hexan-2-amine

2-methylbicyclo[2.2.0]hexan-2-amine (PubChem CID 123842739) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 2-methylbicyclo[2.2.0]hexan-2-amine.

Molecular Properties

Compound Name2-methylbicyclo[2.2.0]hexan-2-amine
PubChem CID123842739
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name2-methylbicyclo[2.2.0]hexan-2-amine
SMILESCC1(N)CC2CCC21
InChIInChI=1S/C7H13N/c1-7(8)4-5-2-3-6(5)7/h5-6H,2-4,8H2,1H3
InChIKeyMLWRZECVIYBMLR-UHFFFAOYSA-N
XLogP1.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methylbicyclo[2.2.0]hexan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,7-trimethylbicyclo[2.2.1]heptane
CID 18669850
1-methylcyclopropane-1,2-diamine
CID 15182447
1-methyltricyclo[4.2.0.03,8]octane
CID 146747804
3-methyltricyclo[3.2.0.02,7]heptan-3-amine
CID 131861725
2,2,4-trimethylbicyclo[5.2.0]nonane
CID 123508525
(1S,3S,5S,10S)-3-ethyl-5,10-dimethyltricyclo[7.1.1.02,6]undecane-2,5-diamine
CID 163983597
cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide
CID 170054920
trans-(1R,2S)-1-methylcyclobutane-1,2-diamine
CID 12699189
(1R)-1,2-dimethylcyclobutan-1-amine
CID 147198625
ethane;methane;3,4,6,7-tetramethyl-4-propyl-2,3,4a,5,7,8,9,9a-octahydro-1H-benzo[7]annulen-6-amine
CID 168883513
spiro[2-azabicyclo[1.1.0]butane-4,2'-bicyclo[2.2.0]hexane]
CID 163598015
(2R)-2-methylbicyclo[3.1.1]heptan-2-amine
CID 55290522

Frequently Asked Questions

What is the IUPAC name of 2-methylbicyclo[2.2.0]hexan-2-amine?
The IUPAC name of 2-methylbicyclo[2.2.0]hexan-2-amine (CID 123842739) is 2-methylbicyclo[2.2.0]hexan-2-amine.
What is the SMILES notation for 2-methylbicyclo[2.2.0]hexan-2-amine?
The canonical SMILES for 2-methylbicyclo[2.2.0]hexan-2-amine is CC1(N)CC2CCC21.
What is the InChIKey of 2-methylbicyclo[2.2.0]hexan-2-amine?
The InChIKey is MLWRZECVIYBMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-7(8)4-5-2-3-6(5)7/h5-6H,2-4,8H2,1H3.
What are the key properties of 2-methylbicyclo[2.2.0]hexan-2-amine?
2-methylbicyclo[2.2.0]hexan-2-amine has a molecular weight of 111.19 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 2-methylbicyclo[2.2.0]hexan-2-amine is sourced from PubChem (CID 123842739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).