N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine

C14H23N3O — CID 103082859

IUPACN-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCOC1CCC(NC2CCCc3c2cnn3C)C1
InChIInChI=1S/C14H23N3O/c1-17-14-5-3-4-13(12(14)9-15-17)16-10-6-7-11(8-10)18-2/h9-11,13,16H,3-8H2,1-2H3
InChIKeyGXAGCQNBKFAVJN-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.95
Rot. Bonds3

About N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine

N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (PubChem CID 103082859) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine.

Molecular Properties

Compound NameN-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
PubChem CID103082859
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCOC1CCC(NC2CCCc3c2cnn3C)C1
InChIInChI=1S/C14H23N3O/c1-17-14-5-3-4-13(12(14)9-15-17)16-10-6-7-11(8-10)18-2/h9-11,13,16H,3-8H2,1-2H3
InChIKeyGXAGCQNBKFAVJN-UHFFFAOYSA-N
XLogP1.95
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-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-(3-ethoxycyclobutyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 112553059
1-methyl-N-(3-methylcyclohexyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 43317523
3-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]cyclohexan-1-ol
CID 43751424
1-methyl-N-[4-(trifluoromethyl)cyclohexyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 43730478
N-(1,5-dimethylpyrrolidin-3-yl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 81297409
1-methyl-N-(4-propylcyclohexyl)-4,5,6,7-tetrahydroindazol-4-amine
CID 43435437
N-(1,4-dioxaspiro[4.5]decan-8-yl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43727362
1-methyl-N-(2-methylthian-3-yl)-4,5,6,7-tetrahydroindazol-4-amine
CID 79957211
1-methyl-N-propyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43254492
1-methyl-N-[(2-methylcyclopropyl)methyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 115694381
2-[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]cyclopentane-1-carbonitrile
CID 62962746
N-(2-chloroprop-2-enyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 115890898

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The IUPAC name of N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (CID 103082859) is N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine.
What is the SMILES notation for N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The canonical SMILES for N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine is COC1CCC(NC2CCCc3c2cnn3C)C1.
What is the InChIKey of N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
The InChIKey is GXAGCQNBKFAVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-17-14-5-3-4-13(12(14)9-15-17)16-10-6-7-11(8-10)18-2/h9-11,13,16H,3-8H2,1-2H3.
What are the key properties of N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine?
N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine has a molecular weight of 249.36 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxycyclopentyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine is sourced from PubChem (CID 103082859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).