2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine

C10H20N4 — CID 103568533

IUPAC2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine
SMILESCCC(C)(CN)CNc1ccn(C)n1
InChIInChI=1S/C10H20N4/c1-4-10(2,7-11)8-12-9-5-6-14(3)13-9/h5-6H,4,7-8,11H2,1-3H3,(H,12,13)
InChIKeyACFVJNHLLVHHIQ-UHFFFAOYSA-N
MW196.30 g/mol
LogP1.21
Rot. Bonds5

About 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine

2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine (PubChem CID 103568533) has the molecular formula C10H20N4 and a molecular weight of 196.30 g/mol. Its IUPAC name is 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine.

Molecular Properties

Compound Name2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine
PubChem CID103568533
Molecular FormulaC10H20N4
Molecular Weight196.30 g/mol
Exact Mass196.17
IUPAC Name2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine
SMILESCCC(C)(CN)CNc1ccn(C)n1
InChIInChI=1S/C10H20N4/c1-4-10(2,7-11)8-12-9-5-6-14(3)13-9/h5-6H,4,7-8,11H2,1-3H3,(H,12,13)
InChIKeyACFVJNHLLVHHIQ-UHFFFAOYSA-N
XLogP1.21
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine
CID 103568549
N'-(1-methylpyrazol-3-yl)hexane-1,6-diamine
CID 103568574
ethyl 2-[(1-methylpyrazol-3-yl)amino]acetate
CID 79778560
2-[(1-methylpyrazol-3-yl)amino]ethanol
CID 23443606
2-methyl-4-[(1-methylpyrazol-3-yl)amino]butan-2-ol
CID 79779568
2-[(1-methylpyrazol-3-yl)amino]acetaldehyde
CID 91444715
(1-methylpyrazol-3-yl)hydrazine;trihydrochloride
CID 75525830
N-[2-[2-(aminomethyl)phenyl]ethyl]-1-methylpyrazol-3-amine
CID 103568727
N-[(2-ethylphenyl)methyl]-1-methylpyrazol-3-amine
CID 62392134
(2R)-1-[(1-methylpyrazol-3-yl)amino]propan-2-ol
CID 106932300
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-1-methylpyrazol-3-amine
CID 71971585
N-(2-tert-butylsulfonylethyl)-1-methylpyrazol-3-amine
CID 106723990

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The IUPAC name of 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine (CID 103568533) is 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine.
What is the SMILES notation for 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The canonical SMILES for 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine is CCC(C)(CN)CNc1ccn(C)n1.
What is the InChIKey of 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The InChIKey is ACFVJNHLLVHHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4/c1-4-10(2,7-11)8-12-9-5-6-14(3)13-9/h5-6H,4,7-8,11H2,1-3H3,(H,12,13).
What are the key properties of 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine?
2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine has a molecular weight of 196.30 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-N'-(1-methylpyrazol-3-yl)propane-1,3-diamine is sourced from PubChem (CID 103568533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).