N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine

C14H24N2O — CID 114054421

IUPACN-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine
SMILESCCNC(c1ncccc1OC)C(C)C(C)C
InChIInChI=1S/C14H24N2O/c1-6-15-13(11(4)10(2)3)14-12(17-5)8-7-9-16-14/h7-11,13,15H,6H2,1-5H3
InChIKeyRIPUANQQASSMIK-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.03
Rot. Bonds6

About N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine

N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine (PubChem CID 114054421) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine
PubChem CID114054421
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine
SMILESCCNC(c1ncccc1OC)C(C)C(C)C
InChIInChI=1S/C14H24N2O/c1-6-15-13(11(4)10(2)3)14-12(17-5)8-7-9-16-14/h7-11,13,15H,6H2,1-5H3
InChIKeyRIPUANQQASSMIK-UHFFFAOYSA-N
XLogP3.03
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxy-2-pyridinyl)-2,3-dimethyl-N-propylbutan-1-amine
CID 114054565
N-ethyl-1-(3-methoxypyrazin-2-yl)-2,3-dimethylbutan-1-amine
CID 105032262
1-(2,6-dimethoxyphenyl)-N-ethyl-2,3-dimethylbutan-1-amine
CID 105052132
3-ethoxy-N-ethyl-1-(3-methoxy-2-pyridinyl)propan-1-amine
CID 114054018
(1S)-1-(3-methoxy-2-pyridinyl)-2-methylpropan-1-amine
CID 130691803
2-(diethoxymethyl)-3-methoxypyridine
CID 121221666
N-[(5-bromothiophen-3-yl)-(3-methoxy-2-pyridinyl)methyl]ethanamine
CID 114054416
1-(3-methoxy-2-pyridinyl)pentan-1-amine
CID 55296724
2-(dichloromethyl)-3-methoxypyridine
CID 141354456
N-[(3-methoxy-2-pyridinyl)-(2-methylthiolan-2-yl)methyl]ethanamine
CID 114054541
1-(3-methoxy-2-pyridinyl)-N',N'-dimethyl-N-propylethane-1,2-diamine
CID 114053900
N-[(2-fluoro-3-methoxyphenyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
CID 82808223

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine?
The IUPAC name of N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine (CID 114054421) is N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine?
The canonical SMILES for N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine is CCNC(c1ncccc1OC)C(C)C(C)C.
What is the InChIKey of N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine?
The InChIKey is RIPUANQQASSMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-6-15-13(11(4)10(2)3)14-12(17-5)8-7-9-16-14/h7-11,13,15H,6H2,1-5H3.
What are the key properties of N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine?
N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methoxy-2-pyridinyl)-2,3-dimethylbutan-1-amine is sourced from PubChem (CID 114054421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).