4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine

C16H20N2O — CID 115757945

IUPAC4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine
SMILESCC1(NCc2ccc3ccccc3n2)CCOCC1
InChIInChI=1S/C16H20N2O/c1-16(8-10-19-11-9-16)17-12-14-7-6-13-4-2-3-5-15(13)18-14/h2-7,17H,8-12H2,1H3
InChIKeyHMXJSDWBYMKSQJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.89
Rot. Bonds3

About 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine

4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine (PubChem CID 115757945) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine.

Molecular Properties

Compound Name4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine
PubChem CID115757945
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine
SMILESCC1(NCc2ccc3ccccc3n2)CCOCC1
InChIInChI=1S/C16H20N2O/c1-16(8-10-19-11-9-16)17-12-14-7-6-13-4-2-3-5-15(13)18-14/h2-7,17H,8-12H2,1H3
InChIKeyHMXJSDWBYMKSQJ-UHFFFAOYSA-N
XLogP2.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(chloromethyl)-N-(quinolin-2-ylmethyl)oxan-4-amine
CID 106299799
N-[(2-methylthiolan-2-yl)methyl]-1-quinolin-2-ylmethanamine
CID 80528780
2-[[(4-methyloxan-4-yl)amino]methyl]-3H-quinazolin-4-one
CID 136984258
1-(2,2-dimethylcyclopropyl)-N-(quinolin-2-ylmethyl)methanamine
CID 103699442
4-methyl-N-[(1-phenylpyrazol-3-yl)methyl]oxan-4-amine
CID 115897887
N-(quinolin-2-ylmethyl)-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 79352821
4-methyl-N-[(4-phenylphenyl)methyl]oxan-4-amine
CID 115758046
N-(quinolin-2-ylmethyl)butan-2-amine
CID 43183332
1-(4-aminooxan-4-yl)-2-quinolin-2-ylethanone
CID 116604768
[4-(quinolin-2-ylmethoxy)oxan-4-yl]methanamine
CID 65051820
[1-(1-methylcyclopentyl)-2-quinolin-2-ylethyl]hydrazine
CID 105316272
4-methyl-N-(quinolin-2-ylmethyl)pentan-2-amine
CID 43372170

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine?
The IUPAC name of 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine (CID 115757945) is 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine.
What is the SMILES notation for 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine?
The canonical SMILES for 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine is CC1(NCc2ccc3ccccc3n2)CCOCC1.
What is the InChIKey of 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine?
The InChIKey is HMXJSDWBYMKSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-16(8-10-19-11-9-16)17-12-14-7-6-13-4-2-3-5-15(13)18-14/h2-7,17H,8-12H2,1H3.
What are the key properties of 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine?
4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(quinolin-2-ylmethyl)oxan-4-amine is sourced from PubChem (CID 115757945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).