2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine

C12H26N2O — CID 63069690

IUPAC2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine
SMILESCCOC(CN)CCN1CCCCC1C
InChIInChI=1S/C12H26N2O/c1-3-15-12(10-13)7-9-14-8-5-4-6-11(14)2/h11-12H,3-10,13H2,1-2H3
InChIKeyMPGIXPBRUNWOGF-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.61
Rot. Bonds6

About 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine

2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine (PubChem CID 63069690) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine.

Molecular Properties

Compound Name2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine
PubChem CID63069690
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine
SMILESCCOC(CN)CCN1CCCCC1C
InChIInChI=1S/C12H26N2O/c1-3-15-12(10-13)7-9-14-8-5-4-6-11(14)2/h11-12H,3-10,13H2,1-2H3
InChIKeyMPGIXPBRUNWOGF-UHFFFAOYSA-N
XLogP1.61
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 ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-ethoxybutan-1-amine
CID 63070084
2-ethoxy-4-(2-propylpiperidin-1-yl)butan-1-amine
CID 83052818
4-(2,3-dimethylpiperidin-1-yl)-2-ethoxybutan-1-amine
CID 63069725
2-ethoxy-4-pyrrolidin-1-ylbutan-1-amine
CID 63072558
1-(4-amino-3-ethoxybutyl)pyrrolidine-2-carboxamide
CID 63072374
1-(4-amino-3-ethoxybutyl)-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one
CID 103194932
2-methoxy-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 106114423
2-ethoxy-3-(2-ethylazepan-1-yl)propan-1-amine
CID 104689096
1-(3-amino-2-ethoxypropyl)piperidine-2-carboxamide
CID 63071979
ethyl 1-(3-amino-2-ethoxypropyl)piperidine-2-carboxylate
CID 115538704
N-(2,2-diethoxyethyl)-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 81094325
2-ethoxy-3-(4-ethyl-3-methylpiperazin-1-yl)propan-1-amine
CID 63604012

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine?
The IUPAC name of 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine (CID 63069690) is 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine.
What is the SMILES notation for 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine?
The canonical SMILES for 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine is CCOC(CN)CCN1CCCCC1C.
What is the InChIKey of 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine?
The InChIKey is MPGIXPBRUNWOGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-15-12(10-13)7-9-14-8-5-4-6-11(14)2/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine?
2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-(2-methylpiperidin-1-yl)butan-1-amine is sourced from PubChem (CID 63069690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).