N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine

C12H26N2O — CID 107505238

IUPACN-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine
SMILESCCNC(COC)CN1CCCCC1C
InChIInChI=1S/C12H26N2O/c1-4-13-12(10-15-3)9-14-8-6-5-7-11(14)2/h11-13H,4-10H2,1-3H3
InChIKeyBLUJEFBINFOIFU-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds6

About N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine

N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine (PubChem CID 107505238) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine
PubChem CID107505238
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine
SMILESCCNC(COC)CN1CCCCC1C
InChIInChI=1S/C12H26N2O/c1-4-13-12(10-15-3)9-14-8-6-5-7-11(14)2/h11-13H,4-10H2,1-3H3
InChIKeyBLUJEFBINFOIFU-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 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 ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine
CID 62042499
N-ethyl-1-methoxy-3-pyrrolidin-1-ylpropan-2-amine
CID 107505229
N-ethyl-1-methoxy-3-(4-methylpiperidin-1-yl)propan-2-amine
CID 107505226
1-(3,4-dimethylpiperazin-1-yl)-N-ethyl-3-methoxypropan-2-amine
CID 107505746
N-ethyl-1-methoxy-3-(4-methylazepan-1-yl)propan-2-amine
CID 107505756
1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-ethyl-3-methoxypropan-2-amine
CID 107505868
N-ethyl-1-(3-ethylpiperidin-1-yl)-3-methoxypropan-2-amine
CID 107505415
1-(2,4-dimethyl-1,4-diazepan-1-yl)-3-methoxy-N-propylpropan-2-amine
CID 114086627
N-ethyl-1-methoxy-3-(3-propan-2-ylpyrrolidin-1-yl)propan-2-amine
CID 107505935
2-(ethylamino)-1-(2-methylazocan-1-yl)pentan-3-one
CID 71154610
1-methoxy-N-methyl-3-(2-propylpiperidin-1-yl)propan-2-amine
CID 107505926
4-(2-methylpiperidin-1-yl)-3-(propylamino)butan-1-ol
CID 64898364

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine?
The IUPAC name of N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine (CID 107505238) is N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine?
The canonical SMILES for N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine is CCNC(COC)CN1CCCCC1C.
What is the InChIKey of N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine?
The InChIKey is BLUJEFBINFOIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-13-12(10-15-3)9-14-8-6-5-7-11(14)2/h11-13H,4-10H2,1-3H3.
What are the key properties of N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine?
N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine is sourced from PubChem (CID 107505238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).