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

C17H24N4 — CID 62284159

IUPACN-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine
SMILESCC(C)CNCc1cccc(N(C)Cc2ccncc2)n1
InChIInChI=1S/C17H24N4/c1-14(2)11-19-12-16-5-4-6-17(20-16)21(3)13-15-7-9-18-10-8-15/h4-10,14,19H,11-13H2,1-3H3
InChIKeyDJVMLIJNQTWNKI-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.86
Rot. Bonds7

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

N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine (PubChem CID 62284159) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine
PubChem CID62284159
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine
SMILESCC(C)CNCc1cccc(N(C)Cc2ccncc2)n1
InChIInChI=1S/C17H24N4/c1-14(2)11-19-12-16-5-4-6-17(20-16)21(3)13-15-7-9-18-10-8-15/h4-10,14,19H,11-13H2,1-3H3
InChIKeyDJVMLIJNQTWNKI-UHFFFAOYSA-N
XLogP2.86
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine?
The IUPAC name of N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine (CID 62284159) is N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine is CC(C)CNCc1cccc(N(C)Cc2ccncc2)n1.
What is the InChIKey of N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine?
The InChIKey is DJVMLIJNQTWNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-14(2)11-19-12-16-5-4-6-17(20-16)21(3)13-15-7-9-18-10-8-15/h4-10,14,19H,11-13H2,1-3H3.
What are the key properties of N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine?
N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine has a molecular weight of 284.41 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 62284159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).