[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine

C10H12N4 — CID 16786119

IUPAC[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine
SMILESCc1nccn1-c1ccc(CN)cn1
InChIInChI=1S/C10H12N4/c1-8-12-4-5-14(8)10-3-2-9(6-11)7-13-10/h2-5,7H,6,11H2,1H3
InChIKeyBXUZWIDXDFAHAF-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.03
Rot. Bonds2

About [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine

[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine (PubChem CID 16786119) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine
PubChem CID16786119
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine
SMILESCc1nccn1-c1ccc(CN)cn1
InChIInChI=1S/C10H12N4/c1-8-12-4-5-14(8)10-3-2-9(6-11)7-13-10/h2-5,7H,6,11H2,1H3
InChIKeyBXUZWIDXDFAHAF-UHFFFAOYSA-N
XLogP1.03
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

CID 1530
CID 1530
CID 49971
CID 49971
CID 9815679
CID 9815679
CID 3040177
CID 3040177
CID 9989505
CID 9989505
CID 2178
CID 2178
CID 72080
CID 72080
CID 10421577
CID 10421577
CID 78960
CID 78960
CID 199307
CID 199307
CID 1132927
CID 1132927
CID 5260647
CID 5260647

Frequently Asked Questions

What is the IUPAC name of [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine (CID 16786119) is [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine is Cc1nccn1-c1ccc(CN)cn1.
What is the InChIKey of [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine?
The InChIKey is BXUZWIDXDFAHAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-8-12-4-5-14(8)10-3-2-9(6-11)7-13-10/h2-5,7H,6,11H2,1H3.
What are the key properties of [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine?
[6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine has a molecular weight of 188.23 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylimidazol-1-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 16786119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).