N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine

C15H27N3O — CID 102700801

IUPACN-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCOC(C)CNc1cc(CNCC(C)C)cc(C)n1
InChIInChI=1S/C15H27N3O/c1-11(2)8-16-10-14-6-12(3)18-15(7-14)17-9-13(4)19-5/h6-7,11,13,16H,8-10H2,1-5H3,(H,17,18)
InChIKeyVEWJMHHGYKRMGH-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.58
Rot. Bonds8

About N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine

N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 102700801) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID102700801
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCOC(C)CNc1cc(CNCC(C)C)cc(C)n1
InChIInChI=1S/C15H27N3O/c1-11(2)8-16-10-14-6-12(3)18-15(7-14)17-9-13(4)19-5/h6-7,11,13,16H,8-10H2,1-5H3,(H,17,18)
InChIKeyVEWJMHHGYKRMGH-UHFFFAOYSA-N
XLogP2.58
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 102700801) is N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine is COC(C)CNc1cc(CNCC(C)C)cc(C)n1.
What is the InChIKey of N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is VEWJMHHGYKRMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-11(2)8-16-10-14-6-12(3)18-15(7-14)17-9-13(4)19-5/h6-7,11,13,16H,8-10H2,1-5H3,(H,17,18).
What are the key properties of N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine?
N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 265.40 g/mol, XLogP of 2.58, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)-6-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 102700801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).