3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine

C15H19N3O — CID 139370148

IUPAC3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine
SMILESCC(C)COc1ccccc1-c1ccc(N)nc1N
InChIInChI=1S/C15H19N3O/c1-10(2)9-19-13-6-4-3-5-11(13)12-7-8-14(16)18-15(12)17/h3-8,10H,9H2,1-2H3,(H4,16,17,18)
InChIKeyDUOWCXXPONCIKP-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.95
Rot. Bonds4

About 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine

3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine (PubChem CID 139370148) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine
PubChem CID139370148
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine
SMILESCC(C)COc1ccccc1-c1ccc(N)nc1N
InChIInChI=1S/C15H19N3O/c1-10(2)9-19-13-6-4-3-5-11(13)12-7-8-14(16)18-15(12)17/h3-8,10H,9H2,1-2H3,(H4,16,17,18)
InChIKeyDUOWCXXPONCIKP-UHFFFAOYSA-N
XLogP2.95
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-phenylmethoxyphenyl)pyridine-2,6-diamine
CID 139370202
3-[2-(1-methoxyethoxy)phenyl]pyridine-2,6-diamine
CID 139369576
3-(2-propan-2-ylphenyl)pyridine-2,6-diamine;hydrochloride
CID 156692790
3-methoxy-4-[2-(2-methylpropoxy)phenyl]pyridine
CID 163311699
3-(2-methylpropoxy)quinoxalin-2-amine
CID 102987688
2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine
CID 82452952
3-[2-(methoxymethyl)phenyl]pyridine-2,6-diamine;hydrochloride
CID 156692785
3-(chloromethyl)-2-methyl-6-[2-(2-methylpropoxy)phenyl]pyridine
CID 82452946
5,6-dimethyl-2-[2-(2-methylpropoxy)phenyl]-1H-benzimidazole
CID 110538872
5-[2-(2-methylpropoxy)phenyl]thiophene-2-carboxylic acid
CID 167136873
ethyl 2-amino-4-methyl-6-[2-(2-methylpropoxy)phenyl]pyrimidine-5-carboxylate
CID 54851288
3-amino-6-[2-(2-methylpropoxy)phenyl]-1-propan-2-ylpyridin-2-one
CID 82467021

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine?
The IUPAC name of 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine (CID 139370148) is 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine.
What is the SMILES notation for 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine?
The canonical SMILES for 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine is CC(C)COc1ccccc1-c1ccc(N)nc1N.
What is the InChIKey of 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine?
The InChIKey is DUOWCXXPONCIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)9-19-13-6-4-3-5-11(13)12-7-8-14(16)18-15(12)17/h3-8,10H,9H2,1-2H3,(H4,16,17,18).
What are the key properties of 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine?
3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine has a molecular weight of 257.34 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine is sourced from PubChem (CID 139370148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).