1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride

C10H23ClN2O — CID 131089433

IUPAC1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride
SMILESCOCC(C)N1CCC(C)(N)CC1.Cl
InChIInChI=1S/C10H22N2O.ClH/c1-9(8-13-3)12-6-4-10(2,11)5-7-12;/h9H,4-8,11H2,1-3H3;1H
InChIKeyAGGJXPIBTXQBNZ-UHFFFAOYSA-N
MW222.76 g/mol
LogP1.26
Rot. Bonds3

About 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride

1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride (PubChem CID 131089433) has the molecular formula C10H23ClN2O and a molecular weight of 222.76 g/mol. Its IUPAC name is 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride.

Molecular Properties

Compound Name1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride
PubChem CID131089433
Molecular FormulaC10H23ClN2O
Molecular Weight222.76 g/mol
Exact Mass222.15
IUPAC Name1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride
SMILESCOCC(C)N1CCC(C)(N)CC1.Cl
InChIInChI=1S/C10H22N2O.ClH/c1-9(8-13-3)12-6-4-10(2,11)5-7-12;/h9H,4-8,11H2,1-3H3;1H
InChIKeyAGGJXPIBTXQBNZ-UHFFFAOYSA-N
XLogP1.26
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.76
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methoxypropan-2-yl)-3-methylpyrrolidin-3-ol
CID 103728291
1-(1-methoxypropan-2-yl)-4-methylazepan-4-ol
CID 107408062
1-(1-methoxypropan-2-yl)piperazine;dihydrochloride
CID 50988385
1-[(2S)-1-methoxypropan-2-yl]-4-methylpiperazine
CID 162764220
1-(1-methoxypropan-2-yl)piperidin-4-one
CID 24709095
4-methyl-1-(1-methylsulfanylethyl)piperidin-4-amine
CID 146535907
1-(4-methoxybutan-2-yl)-4-methylpiperidine-4-carbonitrile
CID 103993923
(3R)-1-[4-[(2R)-1-methoxypropan-2-yl]piperazin-1-yl]-3-methylpentan-1-one
CID 100704548
2-[1-ethyl-8-[(2S)-1-methoxypropan-2-yl]-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]acetamide
CID 26229853
N-(2,2-dimethylpropyl)-2-[4-(1-methoxypropan-2-yl)piperazin-1-yl]acetamide
CID 135173691
[4-[(2-chlorophenyl)methyl]-1-(1-methoxypropan-2-yl)piperidin-4-yl]methanol
CID 45173972
1-(1-methoxy-3-methylbutan-2-yl)-N,4-dimethylpiperidin-4-amine
CID 115304094

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride?
The IUPAC name of 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride (CID 131089433) is 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride.
What is the SMILES notation for 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride?
The canonical SMILES for 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride is COCC(C)N1CCC(C)(N)CC1.Cl.
What is the InChIKey of 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride?
The InChIKey is AGGJXPIBTXQBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O.ClH/c1-9(8-13-3)12-6-4-10(2,11)5-7-12;/h9H,4-8,11H2,1-3H3;1H.
What are the key properties of 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride?
1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride has a molecular weight of 222.76 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropan-2-yl)-4-methylpiperidin-4-amine;hydrochloride is sourced from PubChem (CID 131089433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).