4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol

C11H24N2O2 — CID 131936935

IUPAC4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol
SMILESCOCC(C)NCC1(O)CCN(C)CC1
InChIInChI=1S/C11H24N2O2/c1-10(8-15-3)12-9-11(14)4-6-13(2)7-5-11/h10,12,14H,4-9H2,1-3H3
InChIKeyOCJSGCXIDGFRGG-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.07
Rot. Bonds5

About 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol

4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol (PubChem CID 131936935) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol.

Molecular Properties

Compound Name4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol
PubChem CID131936935
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol
SMILESCOCC(C)NCC1(O)CCN(C)CC1
InChIInChI=1S/C11H24N2O2/c1-10(8-15-3)12-9-11(14)4-6-13(2)7-5-11/h10,12,14H,4-9H2,1-3H3
InChIKeyOCJSGCXIDGFRGG-UHFFFAOYSA-N
XLogP0.07
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-methoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 65107675
1-methyl-4-[(6-methylhept-5-en-2-ylamino)methyl]piperidin-4-ol
CID 131903414
1-[(4-methoxybutan-2-ylamino)methyl]cycloheptan-1-ol
CID 64604658
1-methoxy-N-[(1-propylcyclopropyl)methyl]propan-2-amine
CID 115695256
(4-hydroxy-1-methylpiperidin-4-yl)methylurea
CID 67593720
(2S)-1-methoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]propan-2-amine
CID 95132389
N-[2-(2,2-dimethylpyrrolidin-1-yl)ethyl]-1-methoxypropan-2-amine
CID 63218159
1-[(1-hydroxypropan-2-ylamino)methyl]cyclobutan-1-ol
CID 130502696
methyl 3-[(1-hydroxycycloheptyl)methylamino]butanoate
CID 65122312
1-[[(1-hydroxy-3-methoxypropan-2-yl)amino]methyl]cycloheptan-1-ol
CID 106190470
4-hydroxy-4-[(4-methoxybutan-2-ylamino)methyl]cyclohexane-1-carboxylic acid
CID 106499519
2-[(1-hydroxycyclobutyl)methylamino]-3-methoxypropanoic acid
CID 103268359

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol?
The IUPAC name of 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol (CID 131936935) is 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol.
What is the SMILES notation for 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol?
The canonical SMILES for 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol is COCC(C)NCC1(O)CCN(C)CC1.
What is the InChIKey of 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol?
The InChIKey is OCJSGCXIDGFRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10(8-15-3)12-9-11(14)4-6-13(2)7-5-11/h10,12,14H,4-9H2,1-3H3.
What are the key properties of 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol?
4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol has a molecular weight of 216.32 g/mol, XLogP of 0.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methoxypropan-2-ylamino)methyl]-1-methylpiperidin-4-ol is sourced from PubChem (CID 131936935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).