2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine

C12H24N4 — CID 79053603

IUPAC2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine
SMILESCNC(Cc1cnn(C)c1)C(C)(C)N(C)C
InChIInChI=1S/C12H24N4/c1-12(2,15(4)5)11(13-3)7-10-8-14-16(6)9-10/h8-9,11,13H,7H2,1-6H3
InChIKeyYHJMHJMFAUTMRN-UHFFFAOYSA-N
MW224.35 g/mol
LogP0.89
Rot. Bonds5

About 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine

2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine (PubChem CID 79053603) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine
PubChem CID79053603
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine
SMILESCNC(Cc1cnn(C)c1)C(C)(C)N(C)C
InChIInChI=1S/C12H24N4/c1-12(2,15(4)5)11(13-3)7-10-8-14-16(6)9-10/h8-9,11,13H,7H2,1-6H3
InChIKeyYHJMHJMFAUTMRN-UHFFFAOYSA-N
XLogP0.89
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-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-N,3-N-diethyl-2-N,3-dimethyl-1-(1-methylpyrazol-4-yl)pentane-2,3-diamine
CID 79068516
N,3-dimethyl-1-(1-methylpyrazol-4-yl)-3-pyrrolidin-1-ylpentan-2-amine
CID 79068880
N,2,2-trimethyl-7-(1-methylpyrazol-4-yl)heptan-3-amine
CID 103015930
N,2-dimethyl-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 62530457
1-(4-tert-butylcyclohexyl)-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 65403165
3-ethoxy-3-methyl-1-(1-methylpyrazol-4-yl)-N-propylbutan-2-amine
CID 116727085
N-methyl-1-(1-methylpyrazol-4-yl)-3-propylhexan-2-amine
CID 115821260
N-methyl-1-(1-methylpyrazol-4-yl)pent-4-en-2-amine
CID 116660539
1-cyclooctyl-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 80602955
2-[(1-methylpyrazol-4-yl)methyl]propane-1,3-diol
CID 79450253
N-methyl-4-(1-methylpyrazol-4-yl)butan-2-amine
CID 62125869
3-methyl-1-(1-methylpyrazol-4-yl)pentane-2,3-diol
CID 103448660

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine?
The IUPAC name of 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine (CID 79053603) is 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine.
What is the SMILES notation for 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine?
The canonical SMILES for 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine is CNC(Cc1cnn(C)c1)C(C)(C)N(C)C.
What is the InChIKey of 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine?
The InChIKey is YHJMHJMFAUTMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-12(2,15(4)5)11(13-3)7-10-8-14-16(6)9-10/h8-9,11,13H,7H2,1-6H3.
What are the key properties of 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine?
2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine has a molecular weight of 224.35 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N,3-N,3-tetramethyl-1-(1-methylpyrazol-4-yl)butane-2,3-diamine is sourced from PubChem (CID 79053603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).