2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine

C14H24N6 — CID 66192657

IUPAC2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine
SMILESCC(C)n1cncc1Cn1cc(CNC(C)(C)C)nn1
InChIInChI=1S/C14H24N6/c1-11(2)20-10-15-7-13(20)9-19-8-12(17-18-19)6-16-14(3,4)5/h7-8,10-11,16H,6,9H2,1-5H3
InChIKeyWRYQDYFDUOZXII-UHFFFAOYSA-N
MW276.39 g/mol
LogP1.99
Rot. Bonds5

About 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine

2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine (PubChem CID 66192657) has the molecular formula C14H24N6 and a molecular weight of 276.39 g/mol. Its IUPAC name is 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine
PubChem CID66192657
Molecular FormulaC14H24N6
Molecular Weight276.39 g/mol
Exact Mass276.21
IUPAC Name2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine
SMILESCC(C)n1cncc1Cn1cc(CNC(C)(C)C)nn1
InChIInChI=1S/C14H24N6/c1-11(2)20-10-15-7-13(20)9-19-8-12(17-18-19)6-16-14(3,4)5/h7-8,10-11,16H,6,9H2,1-5H3
InChIKeyWRYQDYFDUOZXII-UHFFFAOYSA-N
XLogP1.99
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine with MolForge

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Related Compounds

2-[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]ethanamine
CID 116641969
2-methyl-N-[[1-(1,3-thiazol-5-ylmethyl)triazol-4-yl]methyl]propan-2-amine
CID 112645383
1-[4-[(tert-butylamino)methyl]triazol-1-yl]propan-2-ol
CID 66193423
N-[[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66192071
N-[[1-(furan-3-ylmethyl)triazol-4-yl]methyl]-2-methylpropan-2-amine
CID 83182735
2-methyl-N-[[1-(3,3,3-trifluoropropyl)triazol-4-yl]methyl]propan-2-amine
CID 66191690
N-[[1-(cyclopropylmethyl)triazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66193655
2-methyl-N-[[3-(2-methylpentan-3-yl)imidazol-4-yl]methyl]propan-2-amine
CID 66148627
N-[2-[4-[(tert-butylamino)methyl]triazol-1-yl]ethyl]-N,3-dimethylbutan-2-amine
CID 62432654
N-[[1-[(4-bromo-3-ethyl-1-methylpyrazol-5-yl)methyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66194590
1-[4-[(tert-butylamino)methyl]triazol-1-yl]-2-methylbutan-2-ol
CID 114497656
2-methyl-N-[(1-octyltriazol-4-yl)methyl]propan-2-amine
CID 66191679

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine (CID 66192657) is 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine is CC(C)n1cncc1Cn1cc(CNC(C)(C)C)nn1.
What is the InChIKey of 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine?
The InChIKey is WRYQDYFDUOZXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6/c1-11(2)20-10-15-7-13(20)9-19-8-12(17-18-19)6-16-14(3,4)5/h7-8,10-11,16H,6,9H2,1-5H3.
What are the key properties of 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine?
2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine has a molecular weight of 276.39 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[(3-propan-2-ylimidazol-4-yl)methyl]triazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 66192657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).