N-propan-2-ylpropan-2-amine;triazol-1-amine

C8H19N5 — CID 23203283

IUPACN-propan-2-ylpropan-2-amine;triazol-1-amine
SMILESCC(C)NC(C)C.Nn1ccnn1
InChIInChI=1S/C6H15N.C2H4N4/c1-5(2)7-6(3)4;3-6-2-1-4-5-6/h5-7H,1-4H3;1-2H,3H2
InChIKeyJCSZCXCPZNOMAF-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.38
Rot. Bonds2

About N-propan-2-ylpropan-2-amine;triazol-1-amine

N-propan-2-ylpropan-2-amine;triazol-1-amine (PubChem CID 23203283) has the molecular formula C8H19N5 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-propan-2-ylpropan-2-amine;triazol-1-amine.

Molecular Properties

Compound NameN-propan-2-ylpropan-2-amine;triazol-1-amine
PubChem CID23203283
Molecular FormulaC8H19N5
Molecular Weight185.27 g/mol
Exact Mass185.16
IUPAC NameN-propan-2-ylpropan-2-amine;triazol-1-amine
SMILESCC(C)NC(C)C.Nn1ccnn1
InChIInChI=1S/C6H15N.C2H4N4/c1-5(2)7-6(3)4;3-6-2-1-4-5-6/h5-7H,1-4H3;1-2H,3H2
InChIKeyJCSZCXCPZNOMAF-UHFFFAOYSA-N
XLogP0.38
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-propan-2-ylpropan-2-amine;triazol-1-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

2H-benzotriazole;triazol-1-amine
CID 174496646
hydrazine;N-propan-2-ylpropan-2-amine
CID 157069346
4-methyl-2-(propan-2-ylamino)-1-(triazol-1-yl)pentan-3-one
CID 159039120
CID 174625889
CID 174625889
(2R)-1-(triazol-1-yl)propan-2-amine
CID 59543908
methyl (2S,3R)-2-amino-3-(triazol-1-yl)butanoate
CID 99737599
N-propan-2-yl-2-(triazol-1-yl)acetamide
CID 79807214
dilithium;magnesium;hydride;N-propan-2-ylpropan-2-amine;trichloride
CID 175311174
triazol-1-ylhydrazine
CID 154372556
2,2-difluoro-N-propan-2-yl-3-(triazol-1-yl)propan-1-amine
CID 165462663
1-[(1S)-1-phenylethyl]triazole
CID 175706857
lithium;azanide;N-propan-2-ylpropan-2-amine
CID 172803690

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylpropan-2-amine;triazol-1-amine?
The IUPAC name of N-propan-2-ylpropan-2-amine;triazol-1-amine (CID 23203283) is N-propan-2-ylpropan-2-amine;triazol-1-amine.
What is the SMILES notation for N-propan-2-ylpropan-2-amine;triazol-1-amine?
The canonical SMILES for N-propan-2-ylpropan-2-amine;triazol-1-amine is CC(C)NC(C)C.Nn1ccnn1.
What is the InChIKey of N-propan-2-ylpropan-2-amine;triazol-1-amine?
The InChIKey is JCSZCXCPZNOMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C2H4N4/c1-5(2)7-6(3)4;3-6-2-1-4-5-6/h5-7H,1-4H3;1-2H,3H2.
What are the key properties of N-propan-2-ylpropan-2-amine;triazol-1-amine?
N-propan-2-ylpropan-2-amine;triazol-1-amine has a molecular weight of 185.27 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylpropan-2-amine;triazol-1-amine is sourced from PubChem (CID 23203283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).