6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine

C15H20N4O2 — CID 79223181

IUPAC6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine
SMILESCc1noc(C)c1CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H20N4O2/c1-9-12(10(2)21-19-9)7-17-14-6-5-13(16)15(18-14)20-8-11-3-4-11/h5-6,11H,3-4,7-8,16H2,1-2H3,(H,17,18)
InChIKeyWYZVNNHUULKSHN-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.67
Rot. Bonds6

About 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine

6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine (PubChem CID 79223181) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine
PubChem CID79223181
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine
SMILESCc1noc(C)c1CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C15H20N4O2/c1-9-12(10(2)21-19-9)7-17-14-6-5-13(16)15(18-14)20-8-11-3-4-11/h5-6,11H,3-4,7-8,16H2,1-2H3,(H,17,18)
InChIKeyWYZVNNHUULKSHN-UHFFFAOYSA-N
XLogP2.67
TPSA86.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine?
The IUPAC name of 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine (CID 79223181) is 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine is Cc1noc(C)c1CNc1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine?
The InChIKey is WYZVNNHUULKSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-9-12(10(2)21-19-9)7-17-14-6-5-13(16)15(18-14)20-8-11-3-4-11/h5-6,11H,3-4,7-8,16H2,1-2H3,(H,17,18).
What are the key properties of 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine?
6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine has a molecular weight of 288.35 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 79223181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).