1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine

C8H11N5 — CID 114554203

IUPAC1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
SMILESCn1nccc1Cn1ccnc1N
InChIInChI=1S/C8H11N5/c1-12-7(2-3-11-12)6-13-5-4-10-8(13)9/h2-5H,6H2,1H3,(H2,9,10)
InChIKeyUIIOPEXDSJMUHG-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.25
Rot. Bonds2

About 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine

1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine (PubChem CID 114554203) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
PubChem CID114554203
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
SMILESCn1nccc1Cn1ccnc1N
InChIInChI=1S/C8H11N5/c1-12-7(2-3-11-12)6-13-5-4-10-8(13)9/h2-5H,6H2,1H3,(H2,9,10)
InChIKeyUIIOPEXDSJMUHG-UHFFFAOYSA-N
XLogP0.25
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-5-[(2-methylimidazol-1-yl)methyl]pyrazole
CID 131018890
4-methyl-1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573735
4-[1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-yl]aniline
CID 103002374
1-[(3,4-dimethylphenyl)methyl]imidazol-2-amine
CID 60861612
5-(chloromethyl)-1-[(2-methylpyrazol-3-yl)methyl]imidazole
CID 66150644
1-(2-aminoimidazol-1-yl)-2-methylpropan-2-ol
CID 165463249
1-(2-methylpyrazol-3-yl)-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 63302358
N-ethyl-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573703
5-(iodomethyl)-1-methylpyrazole
CID 126698907
5-(bromomethyl)-1-methylpyrazole
CID 59589503
6,6-dimethyl-1-[(2-methylpyrazol-3-yl)methyl]-5,7-dihydro-4H-indol-4-amine
CID 55206124
2-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidine-2,5-diamine
CID 103004407

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine (CID 114554203) is 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine is Cn1nccc1Cn1ccnc1N.
What is the InChIKey of 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine?
The InChIKey is UIIOPEXDSJMUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-12-7(2-3-11-12)6-13-5-4-10-8(13)9/h2-5H,6H2,1H3,(H2,9,10).
What are the key properties of 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine?
1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine has a molecular weight of 177.21 g/mol, XLogP of 0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 114554203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).