N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

C15H24N2O2 — CID 81250738

IUPACN-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(OCC2CCOC2)c(CNC(C)C)cn1
InChIInChI=1S/C15H24N2O2/c1-11(2)16-7-14-8-17-12(3)6-15(14)19-10-13-4-5-18-9-13/h6,8,11,13,16H,4-5,7,9-10H2,1-3H3
InChIKeyUUWDZGCDWCQWTP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.30
Rot. Bonds6

About N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine

N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 81250738) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
PubChem CID81250738
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
SMILESCc1cc(OCC2CCOC2)c(CNC(C)C)cn1
InChIInChI=1S/C15H24N2O2/c1-11(2)16-7-14-8-17-12(3)6-15(14)19-10-13-4-5-18-9-13/h6,8,11,13,16H,4-5,7,9-10H2,1-3H3
InChIKeyUUWDZGCDWCQWTP-UHFFFAOYSA-N
XLogP2.30
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine (CID 81250738) is N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is Cc1cc(OCC2CCOC2)c(CNC(C)C)cn1.
What is the InChIKey of N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is UUWDZGCDWCQWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)16-7-14-8-17-12(3)6-15(14)19-10-13-4-5-18-9-13/h6,8,11,13,16H,4-5,7,9-10H2,1-3H3.
What are the key properties of N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine?
N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 264.37 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-4-(oxolan-3-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 81250738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).