N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine

C14H22N2O — CID 115854932

IUPACN-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)C1CCOC1C
InChIInChI=1S/C14H22N2O/c1-4-15-14(13-7-8-17-11(13)3)12-6-5-10(2)16-9-12/h5-6,9,11,13-15H,4,7-8H2,1-3H3
InChIKeyAPLOSNQHXQPRND-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.47
Rot. Bonds4

About N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine

N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 115854932) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID115854932
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)C1CCOC1C
InChIInChI=1S/C14H22N2O/c1-4-15-14(13-7-8-17-11(13)3)12-6-5-10(2)16-9-12/h5-6,9,11,13-15H,4,7-8H2,1-3H3
InChIKeyAPLOSNQHXQPRND-UHFFFAOYSA-N
XLogP2.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methyloxolan-3-yl)-naphthalen-2-ylmethyl]ethanamine
CID 115851069
N-[(6-methyl-3-pyridinyl)-[2-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 105146207
N-[(2-methyloxolan-3-yl)-pyridin-3-ylmethyl]propan-1-amine
CID 115799745
N-[(3-ethylphenyl)-(2-methyloxolan-3-yl)methyl]ethanamine
CID 105018793
N-[(3-ethoxyphenyl)-(2-methyloxolan-3-yl)methyl]ethanamine
CID 105022346
N-[(2,2-dimethylcyclopropyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 107004419
N-[(3,5-dimethoxyphenyl)-(2-methyloxolan-3-yl)methyl]ethanamine
CID 105013645
N-[(6-methyl-3-pyridinyl)-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
CID 115854998
N-[(4-tert-butylcyclohexyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 65415133
[(3-methyloxolan-2-yl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305599
N-[(6-methyl-3-pyridinyl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]ethanamine
CID 105189219
N-[(2-methyloxolan-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]ethanamine
CID 102709792

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine (CID 115854932) is N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine is CCNC(c1ccc(C)nc1)C1CCOC1C.
What is the InChIKey of N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is APLOSNQHXQPRND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-15-14(13-7-8-17-11(13)3)12-6-5-10(2)16-9-12/h5-6,9,11,13-15H,4,7-8H2,1-3H3.
What are the key properties of N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine?
N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 234.34 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyloxolan-3-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 115854932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).