azane;1-methyl-2-propylimidazole

C7H15N3 — CID 174525892

IUPACazane;1-methyl-2-propylimidazole
SMILESCCCc1nccn1C.N
InChIInChI=1S/C7H12N2.H3N/c1-3-4-7-8-5-6-9(7)2;/h5-6H,3-4H2,1-2H3;1H3
InChIKeyKKLQVELWVBBIFX-UHFFFAOYSA-N
MW141.22 g/mol
LogP1.53
Rot. Bonds2

About azane;1-methyl-2-propylimidazole

azane;1-methyl-2-propylimidazole (PubChem CID 174525892) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is azane;1-methyl-2-propylimidazole.

Molecular Properties

Compound Nameazane;1-methyl-2-propylimidazole
PubChem CID174525892
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Nameazane;1-methyl-2-propylimidazole
SMILESCCCc1nccn1C.N
InChIInChI=1S/C7H12N2.H3N/c1-3-4-7-8-5-6-9(7)2;/h5-6H,3-4H2,1-2H3;1H3
InChIKeyKKLQVELWVBBIFX-UHFFFAOYSA-N
XLogP1.53
TPSA52.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methanamine;1-methyl-2-propylimidazole
CID 164902083
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
1-methyl-2-nonylimidazole
CID 67393993
1-methyl-2-pentadecylimidazole
CID 68899434
N-[2-(1-methylimidazol-2-yl)ethyl]propan-1-amine
CID 61214414
2-butyl-1-methylimidazole;fluoroform
CID 162050255
alumane;2-hexyl-1-methylimidazole;tetrahydrochloride
CID 174887731
1-(1-methylimidazol-2-yl)heptane-3,4-diol
CID 103455046
3-(1-methylimidazol-2-yl)-N-propylpropan-1-amine
CID 64503736
2-butyl-1-methylimidazole;propan-2-ol;hydrochloride
CID 175427574
1-methyl-2-(3-methylbutyl)imidazole
CID 68983412
N-[2-(1-methylimidazol-2-yl)ethyl]pentan-1-amine
CID 61214559

Frequently Asked Questions

What is the IUPAC name of azane;1-methyl-2-propylimidazole?
The IUPAC name of azane;1-methyl-2-propylimidazole (CID 174525892) is azane;1-methyl-2-propylimidazole.
What is the SMILES notation for azane;1-methyl-2-propylimidazole?
The canonical SMILES for azane;1-methyl-2-propylimidazole is CCCc1nccn1C.N.
What is the InChIKey of azane;1-methyl-2-propylimidazole?
The InChIKey is KKLQVELWVBBIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2.H3N/c1-3-4-7-8-5-6-9(7)2;/h5-6H,3-4H2,1-2H3;1H3.
What are the key properties of azane;1-methyl-2-propylimidazole?
azane;1-methyl-2-propylimidazole has a molecular weight of 141.22 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1-methyl-2-propylimidazole is sourced from PubChem (CID 174525892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).