N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine

C15H25N3O — CID 82754420

IUPACN-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine
SMILESCC(C)CNCc1cccc(N(C)C2CCOC2)n1
InChIInChI=1S/C15H25N3O/c1-12(2)9-16-10-13-5-4-6-15(17-13)18(3)14-7-8-19-11-14/h4-6,12,14,16H,7-11H2,1-3H3
InChIKeyHUDVPINBZBRNJB-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.05
Rot. Bonds6

About N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine

N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine (PubChem CID 82754420) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine
PubChem CID82754420
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine
SMILESCC(C)CNCc1cccc(N(C)C2CCOC2)n1
InChIInChI=1S/C15H25N3O/c1-12(2)9-16-10-13-5-4-6-15(17-13)18(3)14-7-8-19-11-14/h4-6,12,14,16H,7-11H2,1-3H3
InChIKeyHUDVPINBZBRNJB-UHFFFAOYSA-N
XLogP2.05
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.05
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-(oxolan-3-yl)pyridin-2-amine?
The IUPAC name of N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine (CID 82754420) is N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine is CC(C)CNCc1cccc(N(C)C2CCOC2)n1.
What is the InChIKey of N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine?
The InChIKey is HUDVPINBZBRNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-12(2)9-16-10-13-5-4-6-15(17-13)18(3)14-7-8-19-11-14/h4-6,12,14,16H,7-11H2,1-3H3.
What are the key properties of N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine?
N-methyl-6-[(2-methylpropylamino)methyl]-N-(oxolan-3-yl)pyridin-2-amine has a molecular weight of 263.38 g/mol, XLogP of 2.05, 6 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-(oxolan-3-yl)pyridin-2-amine is sourced from PubChem (CID 82754420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).