N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine

C14H15N3 — CID 43790623

IUPACN-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine
SMILESC1=CC2C(C1)CC2Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C14H15N3/c1-2-9-6-14(12(9)3-1)16-11-5-4-10-8-15-17-13(10)7-11/h1,3-5,7-9,12,14,16H,2,6H2,(H,15,17)
InChIKeyVXYZIBFCYPQHSI-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.94
Rot. Bonds2

About N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine

N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine (PubChem CID 43790623) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine.

Molecular Properties

Compound NameN-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine
PubChem CID43790623
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC NameN-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine
SMILESC1=CC2C(C1)CC2Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C14H15N3/c1-2-9-6-14(12(9)3-1)16-11-5-4-10-8-15-17-13(10)7-11/h1,3-5,7-9,12,14,16H,2,6H2,(H,15,17)
InChIKeyVXYZIBFCYPQHSI-UHFFFAOYSA-N
XLogP2.94
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylcyclopentyl)-1H-indazol-6-amine
CID 64501097
3-(1H-indazol-6-ylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633697
N-(3-methylcyclohexyl)-1H-indazol-6-amine
CID 43743422
N-(5-methylthiolan-3-yl)-1H-indazol-6-amine
CID 79941917
N-(3-propan-2-ylcyclohexyl)-1H-indazol-6-amine
CID 107448253
N-[4-(trifluoromethyl)cyclohexyl]-1H-indazol-6-amine
CID 64753657
N-(4-phenylcyclohexyl)-1H-indazol-6-amine
CID 2847039
N-(1-prop-2-ynylpiperidin-4-yl)-1H-indazol-6-amine
CID 43790640
N-(5,5-dimethylthian-3-yl)-1H-indazol-6-amine
CID 79959113
N-(7-azabicyclo[2.2.1]heptan-2-yl)-1H-indazol-5-amine
CID 67234945
N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]bicyclo[3.2.0]hept-3-en-6-amine
CID 43789664
N-(cyclohexylmethyl)-1H-indazol-6-amine
CID 5333513

Frequently Asked Questions

What is the IUPAC name of N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine?
The IUPAC name of N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine (CID 43790623) is N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine.
What is the SMILES notation for N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine?
The canonical SMILES for N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine is C1=CC2C(C1)CC2Nc1ccc2cn[nH]c2c1.
What is the InChIKey of N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine?
The InChIKey is VXYZIBFCYPQHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c1-2-9-6-14(12(9)3-1)16-11-5-4-10-8-15-17-13(10)7-11/h1,3-5,7-9,12,14,16H,2,6H2,(H,15,17).
What are the key properties of N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine?
N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine has a molecular weight of 225.30 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-bicyclo[3.2.0]hept-3-enyl)-1H-indazol-6-amine is sourced from PubChem (CID 43790623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).