N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine

C15H25N — CID 79352840

IUPACN-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine
SMILESCC1(C)C(CNC2CC3CC=CC32)C1(C)C
InChIInChI=1S/C15H25N/c1-14(2)13(15(14,3)4)9-16-12-8-10-6-5-7-11(10)12/h5,7,10-13,16H,6,8-9H2,1-4H3
InChIKeyGNVQZKAMLMBMQI-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.22
Rot. Bonds3

About N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine

N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine (PubChem CID 79352840) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine.

Molecular Properties

Compound NameN-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine
PubChem CID79352840
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine
SMILESCC1(C)C(CNC2CC3CC=CC32)C1(C)C
InChIInChI=1S/C15H25N/c1-14(2)13(15(14,3)4)9-16-12-8-10-6-5-7-11(10)12/h5,7,10-13,16H,6,8-9H2,1-4H3
InChIKeyGNVQZKAMLMBMQI-UHFFFAOYSA-N
XLogP3.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-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

N-(cyclopropylmethyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 43756772
3-(6-bicyclo[3.2.0]hept-3-enylamino)propan-1-ol
CID 43222698
N-(5-methylhexyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 115325152
N-(2-methylcyclopropyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 62398101
2-N-(6-bicyclo[3.2.0]hept-3-enyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82939082
3-[(6-bicyclo[3.2.0]hept-3-enylamino)methyl]pentan-3-ol
CID 65105673
1-N-(6-bicyclo[3.2.0]hept-3-enyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 43223906
N-[(4-propan-2-ylphenyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine
CID 55136454
N-(furan-2-ylmethyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 43222580
1-N-(6-bicyclo[3.2.0]hept-3-enyl)-3-ethyl-2-N,2-N-dimethylpentane-1,2-diamine
CID 43771706
N-[2-(azepan-1-yl)ethyl]bicyclo[3.2.0]hept-3-en-6-amine
CID 55134374
N-(3-cyclohexyloxypropyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 43225559

Frequently Asked Questions

What is the IUPAC name of N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine?
The IUPAC name of N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine (CID 79352840) is N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine.
What is the SMILES notation for N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine?
The canonical SMILES for N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine is CC1(C)C(CNC2CC3CC=CC32)C1(C)C.
What is the InChIKey of N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine?
The InChIKey is GNVQZKAMLMBMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-14(2)13(15(14,3)4)9-16-12-8-10-6-5-7-11(10)12/h5,7,10-13,16H,6,8-9H2,1-4H3.
What are the key properties of N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine?
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine has a molecular weight of 219.37 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2,3,3-tetramethylcyclopropyl)methyl]bicyclo[3.2.0]hept-3-en-6-amine is sourced from PubChem (CID 79352840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).