5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine

C14H21N5 — CID 66018270

IUPAC5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine
SMILESCCCc1nn(C)c(N(C)Cc2cccnc2)c1N
InChIInChI=1S/C14H21N5/c1-4-6-12-13(15)14(19(3)17-12)18(2)10-11-7-5-8-16-9-11/h5,7-9H,4,6,10,15H2,1-3H3
InChIKeyNIMSLZWIVYIDEP-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.99
Rot. Bonds5

About 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine

5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine (PubChem CID 66018270) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine
PubChem CID66018270
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine
SMILESCCCc1nn(C)c(N(C)Cc2cccnc2)c1N
InChIInChI=1S/C14H21N5/c1-4-6-12-13(15)14(19(3)17-12)18(2)10-11-7-5-8-16-9-11/h5,7-9H,4,6,10,15H2,1-3H3
InChIKeyNIMSLZWIVYIDEP-UHFFFAOYSA-N
XLogP1.99
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-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

5-N-[(5-bromothiophen-3-yl)methyl]-5-N,1-dimethyl-3-propylpyrazole-4,5-diamine
CID 66019454
3-ethyl-5-N,1-dimethyl-5-N-[(4-methylphenyl)methyl]pyrazole-4,5-diamine
CID 66015159
5-N-methyl-5-N-(pyridin-3-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103360517
5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
CID 104533006
5-N-[1-(2-fluorophenyl)ethyl]-5-N,1-dimethyl-3-propylpyrazole-4,5-diamine
CID 66019281
3-ethyl-5-N-(furan-2-ylmethyl)-5-N,1-dimethylpyrazole-4,5-diamine
CID 66014982
4-(aminomethyl)-N-methyl-N-(pyridin-3-ylmethyl)pyridazin-3-amine
CID 80507616
2-N,5-dimethyl-2-N-(pyridin-3-ylmethyl)pyridine-2,3-diamine
CID 66278201
6-hydrazinyl-N-methyl-5-propyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 80906104
N-methyl-N-(pyridin-3-ylmethyl)thiophen-2-amine
CID 154729661
3-amino-5-[methyl(pyridin-3-ylmethyl)amino]thiophene-2-carbonitrile
CID 103509196
4-chloro-6-imidazol-1-yl-N-methyl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 62864215

Frequently Asked Questions

What is the IUPAC name of 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine?
The IUPAC name of 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine (CID 66018270) is 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine.
What is the SMILES notation for 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine?
The canonical SMILES for 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine is CCCc1nn(C)c(N(C)Cc2cccnc2)c1N.
What is the InChIKey of 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine?
The InChIKey is NIMSLZWIVYIDEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-6-12-13(15)14(19(3)17-12)18(2)10-11-7-5-8-16-9-11/h5,7-9H,4,6,10,15H2,1-3H3.
What are the key properties of 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine?
5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine has a molecular weight of 259.36 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,1-dimethyl-3-propyl-5-N-(pyridin-3-ylmethyl)pyrazole-4,5-diamine is sourced from PubChem (CID 66018270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).