N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine

C17H25N3O — CID 103140593

IUPACN-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nn(CC2CCC(C)O2)c2ccccc12
InChIInChI=1S/C17H25N3O/c1-12(2)18-10-16-15-6-4-5-7-17(15)20(19-16)11-14-9-8-13(3)21-14/h4-7,12-14,18H,8-11H2,1-3H3
InChIKeyFRPCLPCYLQJMKJ-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.10
Rot. Bonds5

About N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine

N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine (PubChem CID 103140593) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine
PubChem CID103140593
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nn(CC2CCC(C)O2)c2ccccc12
InChIInChI=1S/C17H25N3O/c1-12(2)18-10-16-15-6-4-5-7-17(15)20(19-16)11-14-9-8-13(3)21-14/h4-7,12-14,18H,8-11H2,1-3H3
InChIKeyFRPCLPCYLQJMKJ-UHFFFAOYSA-N
XLogP3.10
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-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

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine (CID 103140593) is N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine is CC(C)NCc1nn(CC2CCC(C)O2)c2ccccc12.
What is the InChIKey of N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine?
The InChIKey is FRPCLPCYLQJMKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-12(2)18-10-16-15-6-4-5-7-17(15)20(19-16)11-14-9-8-13(3)21-14/h4-7,12-14,18H,8-11H2,1-3H3.
What are the key properties of N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine?
N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine has a molecular weight of 287.41 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(5-methyloxolan-2-yl)methyl]indazol-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 103140593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).