1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine

C16H26N4 — CID 79092451

IUPAC1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine
SMILESCCCNC(Cc1nn(C)c2ccccc12)CN(C)C
InChIInChI=1S/C16H26N4/c1-5-10-17-13(12-19(2)3)11-15-14-8-6-7-9-16(14)20(4)18-15/h6-9,13,17H,5,10-12H2,1-4H3
InChIKeyDGCNRIZMADISRQ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.05
Rot. Bonds7

About 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine

1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine (PubChem CID 79092451) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine
PubChem CID79092451
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine
SMILESCCCNC(Cc1nn(C)c2ccccc12)CN(C)C
InChIInChI=1S/C16H26N4/c1-5-10-17-13(12-19(2)3)11-15-14-8-6-7-9-16(14)20(4)18-15/h6-9,13,17H,5,10-12H2,1-4H3
InChIKeyDGCNRIZMADISRQ-UHFFFAOYSA-N
XLogP2.05
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine 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

3-(1-ethylindazol-3-yl)-1-N,1-N-dimethyl-2-N-propylpropane-1,2-diamine
CID 79095493
4-methyl-1-(1-methylindazol-3-yl)-N-propylhexan-2-amine
CID 105001229
N-ethyl-1-(1-methylindazol-3-yl)heptan-2-amine
CID 105001147
N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine
CID 105001190
1-N,1-N-dimethyl-3-(1-methylpyrazol-3-yl)-2-N-propylpropane-1,2-diamine
CID 82877837
1-N,1-N-dimethyl-2-N-propyl-3-quinolin-4-ylpropane-1,2-diamine
CID 79093124
1-(1,3-dioxolan-2-yl)-N-ethyl-3-(1-methylindazol-3-yl)propan-2-amine
CID 103546905
N-ethyl-3-methoxy-1-(1-methylindazol-3-yl)hexan-2-amine
CID 116719285
2-ethyl-1-(1-methylindazol-3-yl)-N-propylbutan-1-amine
CID 103127777
N-methyl-N-[(1-methylindazol-3-yl)methyl]hydroxylamine
CID 82604100
[5,5,5-trifluoro-1-(1-methylindazol-3-yl)pentan-2-yl]hydrazine
CID 105248982
N-[(1-methylindazol-3-yl)-(1-methylpyrazol-3-yl)methyl]propan-1-amine
CID 103134392

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine?
The IUPAC name of 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine (CID 79092451) is 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine.
What is the SMILES notation for 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine?
The canonical SMILES for 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine is CCCNC(Cc1nn(C)c2ccccc12)CN(C)C.
What is the InChIKey of 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine?
The InChIKey is DGCNRIZMADISRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-5-10-17-13(12-19(2)3)11-15-14-8-6-7-9-16(14)20(4)18-15/h6-9,13,17H,5,10-12H2,1-4H3.
What are the key properties of 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine?
1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine has a molecular weight of 274.41 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine is sourced from PubChem (CID 79092451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).