N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine

C12H23N — CID 130466035

IUPACN,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine
SMILESCC(C)NC1C2CC(C(C)C)CC21
InChIInChI=1S/C12H23N/c1-7(2)9-5-10-11(6-9)12(10)13-8(3)4/h7-13H,5-6H2,1-4H3
InChIKeyJLCBHPBINWZNER-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.66
Rot. Bonds3

About N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine

N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine (PubChem CID 130466035) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine.

Molecular Properties

Compound NameN,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine
PubChem CID130466035
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC NameN,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine
SMILESCC(C)NC1C2CC(C(C)C)CC21
InChIInChI=1S/C12H23N/c1-7(2)9-5-10-11(6-9)12(10)13-8(3)4/h7-13H,5-6H2,1-4H3
InChIKeyJLCBHPBINWZNER-UHFFFAOYSA-N
XLogP2.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-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

4,9-di(propan-2-yl)tricyclo[5.3.0.02,6]decane
CID 156686010
(1S,2R,3S,5R,6R,8R,9R,10S)-N-propan-2-ylpentacyclo[6.3.0.02,6.03,10.05,9]undecan-4-amine
CID 98111841
1-N,3-N,5-N-tri(propan-2-yl)cyclohexane-1,3,5-triamine
CID 101492125
3-propan-2-ylbicyclo[3.1.1]heptane
CID 59796479
4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
4-propan-2-yltricyclo[5.2.1.02,6]decan-8-ol
CID 20697986
N-[1-(4-methylphenyl)ethyl]-3-propan-2-ylcyclobutan-1-amine
CID 103561638
1-cyclohexyl-2,3,5-tri(propan-2-yl)cyclohexane
CID 101318409
1,2,3,4-tetramethyl-6-propan-2-ylcycloheptane
CID 90791175
2-methoxy-5-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 155006906
3-propan-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclobutan-1-amine
CID 103561795
N-[1-(4-chlorophenyl)ethyl]-3-propan-2-ylcyclobutan-1-amine
CID 103560864

Frequently Asked Questions

What is the IUPAC name of N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine?
The IUPAC name of N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine (CID 130466035) is N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine.
What is the SMILES notation for N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine?
The canonical SMILES for N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine is CC(C)NC1C2CC(C(C)C)CC21.
What is the InChIKey of N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine?
The InChIKey is JLCBHPBINWZNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-7(2)9-5-10-11(6-9)12(10)13-8(3)4/h7-13H,5-6H2,1-4H3.
What are the key properties of N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine?
N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine has a molecular weight of 181.32 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-di(propan-2-yl)bicyclo[3.1.0]hexan-6-amine is sourced from PubChem (CID 130466035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).