6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine

C13H14N6 — CID 43710749

IUPAC6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1[nH]ncc1CNc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C13H14N6/c1-10-11(7-17-18-10)6-15-12-2-3-13(16-8-12)19-5-4-14-9-19/h2-5,7-9,15H,6H2,1H3,(H,17,18)
InChIKeyXQXMPKSRHFQOAX-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.91
Rot. Bonds4

About 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine

6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine (PubChem CID 43710749) has the molecular formula C13H14N6 and a molecular weight of 254.30 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
PubChem CID43710749
Molecular FormulaC13H14N6
Molecular Weight254.30 g/mol
Exact Mass254.13
IUPAC Name6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1[nH]ncc1CNc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C13H14N6/c1-10-11(7-17-18-10)6-15-12-2-3-13(16-8-12)19-5-4-14-9-19/h2-5,7-9,15H,6H2,1H3,(H,17,18)
InChIKeyXQXMPKSRHFQOAX-UHFFFAOYSA-N
XLogP1.91
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The IUPAC name of 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine (CID 43710749) is 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The canonical SMILES for 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine is Cc1[nH]ncc1CNc1ccc(-n2ccnc2)nc1.
What is the InChIKey of 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
The InChIKey is XQXMPKSRHFQOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6/c1-10-11(7-17-18-10)6-15-12-2-3-13(16-8-12)19-5-4-14-9-19/h2-5,7-9,15H,6H2,1H3,(H,17,18).
What are the key properties of 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine?
6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine has a molecular weight of 254.30 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 43710749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).