4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol

C10H22N2O — CID 39237893

IUPAC4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol
SMILESCNCC1(O)CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O/c1-9(2)12-6-4-10(13,5-7-12)8-11-3/h9,11,13H,4-8H2,1-3H3
InChIKeyMVVCAVSLIOXMBL-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.44
Rot. Bonds3

About 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol

4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol (PubChem CID 39237893) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol
PubChem CID39237893
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol
SMILESCNCC1(O)CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O/c1-9(2)12-6-4-10(13,5-7-12)8-11-3/h9,11,13H,4-8H2,1-3H3
InChIKeyMVVCAVSLIOXMBL-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]prop-2-enamide
CID 146107032
(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl hypoiodite
CID 155039158
1-propan-2-yl-4-(propan-2-yloxymethyl)piperidin-4-ol
CID 79567229
2-(4-hydroxy-1-propan-2-ylpiperidin-4-yl)acetic acid
CID 62395408
3-(hydroxymethyl)-1-propan-2-ylpyrrolidin-3-ol
CID 82713423
2-ethyl-1-[4-hydroxy-4-(methylaminomethyl)piperidin-1-yl]butan-1-one
CID 39347040
4-nonyl-1-propan-2-ylpiperidin-4-ol
CID 65146910
4-(2-cyclopropylethyl)-1-propan-2-ylpiperidin-4-ol
CID 106590391
4-[(4-fluorophenyl)methyl]-1-propan-2-ylpiperidin-4-ol
CID 60895688
4-(methylaminomethyl)-1-pentylpiperidin-4-ol
CID 95441823
1-propan-2-yl-4-prop-2-enylazepan-4-ol
CID 79734491
N-methyl-1-[1-[(4-propan-2-ylpiperazin-1-yl)methyl]cyclopentyl]methanamine
CID 62257004

Frequently Asked Questions

What is the IUPAC name of 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol?
The IUPAC name of 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol (CID 39237893) is 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol.
What is the SMILES notation for 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol?
The canonical SMILES for 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol is CNCC1(O)CCN(C(C)C)CC1.
What is the InChIKey of 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol?
The InChIKey is MVVCAVSLIOXMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2)12-6-4-10(13,5-7-12)8-11-3/h9,11,13H,4-8H2,1-3H3.
What are the key properties of 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol?
4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol has a molecular weight of 186.30 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylaminomethyl)-1-propan-2-ylpiperidin-4-ol is sourced from PubChem (CID 39237893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).