6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine

C9H15N3O — CID 115320271

IUPAC6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC(C)C)n1
InChIInChI=1S/C9H15N3O/c1-6(2)11-9-7(10)4-5-8(12-9)13-3/h4-6H,10H2,1-3H3,(H,11,12)
InChIKeyLUPFTJLRQCGURZ-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.49
Rot. Bonds3

About 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine

6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine (PubChem CID 115320271) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
PubChem CID115320271
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC(C)C)n1
InChIInChI=1S/C9H15N3O/c1-6(2)11-9-7(10)4-5-8(12-9)13-3/h4-6H,10H2,1-3H3,(H,11,12)
InChIKeyLUPFTJLRQCGURZ-UHFFFAOYSA-N
XLogP1.49
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-2,3-diamine
CID 115320544
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
6-methoxy-2-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2,3-diamine
CID 113286476
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-3-methoxypropan-1-ol
CID 106184124
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-2-(hydroxymethyl)propane-1,3-diol
CID 107845624
2-N-cyclohexyl-6-methoxypyridine-2,3-diamine
CID 115320270
6-methoxy-2-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-2,3-diamine
CID 115320957
2-[(3-amino-6-methoxy-2-pyridinyl)amino]ethanol;dihydrochloride
CID 3019251
2-N-butyl-6-methoxypyridine-2,3-diamine
CID 115320288
6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
CID 113286375
2-N-(3,5-difluorophenyl)-6-methoxypyridine-2,3-diamine
CID 115320365
6-methoxy-2-N-(4-methylpiperazin-1-yl)pyridine-2,3-diamine
CID 83005986

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine?
The IUPAC name of 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine (CID 115320271) is 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine is COc1ccc(N)c(NC(C)C)n1.
What is the InChIKey of 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine?
The InChIKey is LUPFTJLRQCGURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-6(2)11-9-7(10)4-5-8(12-9)13-3/h4-6H,10H2,1-3H3,(H,11,12).
What are the key properties of 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine?
6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine has a molecular weight of 181.24 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine is sourced from PubChem (CID 115320271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).