2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine

C12H26N2O — CID 81079775

IUPAC2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine
SMILESCCC(CN)CCN1CCC(OC)CC1
InChIInChI=1S/C12H26N2O/c1-3-11(10-13)4-7-14-8-5-12(15-2)6-9-14/h11-12H,3-10,13H2,1-2H3
InChIKeyGWOMJODFIWLMGP-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds6

About 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine

2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine (PubChem CID 81079775) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine
PubChem CID81079775
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine
SMILESCCC(CN)CCN1CCC(OC)CC1
InChIInChI=1S/C12H26N2O/c1-3-11(10-13)4-7-14-8-5-12(15-2)6-9-14/h11-12H,3-10,13H2,1-2H3
InChIKeyGWOMJODFIWLMGP-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-methoxy-1-(3-methylbutyl)piperidine
CID 155574416
2-ethyl-4-morpholin-4-ylbutan-1-amine
CID 81080457
2-methoxy-4-(3-methoxypyrrolidin-1-yl)butan-1-amine
CID 103534710
2-ethyl-4-[4-(2-methylpropyl)piperazin-1-yl]butan-1-amine
CID 81079096
3-(aminomethyl)-1-(4-methoxypiperidin-1-yl)pentan-1-one
CID 81071725
(4-methoxypiperidin-1-yl)methanamine
CID 129270206
2-(4-methoxypiperidin-1-yl)butan-1-amine
CID 43372672
2-[2-[4-[4-amino-3-(aminomethyl)butyl]piperazin-1-yl]ethyl]propane-1,3-diamine
CID 68736626
1-(2-bromoethyl)-4-methoxypiperidine
CID 61286304
methyl 4-(4-methoxypiperidin-1-yl)-2-(propylamino)butanoate
CID 63029608
4-(4-methoxypiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64796609
[(4S)-4-methoxyazepan-1-yl]methanamine
CID 178155799

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine?
The IUPAC name of 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine (CID 81079775) is 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine.
What is the SMILES notation for 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine?
The canonical SMILES for 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine is CCC(CN)CCN1CCC(OC)CC1.
What is the InChIKey of 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine?
The InChIKey is GWOMJODFIWLMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-11(10-13)4-7-14-8-5-12(15-2)6-9-14/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine?
2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(4-methoxypiperidin-1-yl)butan-1-amine is sourced from PubChem (CID 81079775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).