[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol

C12H24N2O — CID 116958357

IUPAC[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol
SMILESCNC(C1CCN(C)CC1)C1(CO)CC1
InChIInChI=1S/C12H24N2O/c1-13-11(12(9-15)5-6-12)10-3-7-14(2)8-4-10/h10-11,13,15H,3-9H2,1-2H3
InChIKeyBOOVMZHMXSYWPJ-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.69
Rot. Bonds4

About [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol

[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol (PubChem CID 116958357) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol
PubChem CID116958357
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol
SMILESCNC(C1CCN(C)CC1)C1(CO)CC1
InChIInChI=1S/C12H24N2O/c1-13-11(12(9-15)5-6-12)10-3-7-14(2)8-4-10/h10-11,13,15H,3-9H2,1-2H3
InChIKeyBOOVMZHMXSYWPJ-UHFFFAOYSA-N
XLogP0.69
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclobutane-1-carboxylic acid
CID 116958981
3-[methylamino-(1-methylpiperidin-4-yl)methyl]oxetane-3-carboxylic acid
CID 116959390
2-[methylamino-(1-methylpiperidin-4-yl)methyl]butan-1-ol
CID 116959958
methylamino-(1-methylpiperidin-4-yl)methanethiol
CID 116954601
(1S)-1-(1-methylpiperidin-4-yl)ethane-1,2-diol
CID 143640316
1-(methylamino)-1-(1-methylpiperidin-4-yl)propan-2-ol
CID 116859527
1-[1-(aminomethyl)cyclopropyl]-N-methyl-1-(oxan-4-yl)methanamine
CID 116958494
3-methyl-4-(methylamino)-4-(1-methylpiperidin-4-yl)butanoic acid
CID 116953519
2,3-bis(methylamino)-3-(1-methylpiperidin-4-yl)propanoic acid
CID 116961141
[1-(1-methylpiperidin-4-yl)cyclopropyl]methanol
CID 116963507
[4-(difluoromethyl)-1-methylpiperidin-4-yl]methanol
CID 84767868
3,3-dimethyl-4-(methylamino)-4-(1-methylpiperidin-4-yl)butanoic acid
CID 116953587

Frequently Asked Questions

What is the IUPAC name of [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol (CID 116958357) is [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol is CNC(C1CCN(C)CC1)C1(CO)CC1.
What is the InChIKey of [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol?
The InChIKey is BOOVMZHMXSYWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-13-11(12(9-15)5-6-12)10-3-7-14(2)8-4-10/h10-11,13,15H,3-9H2,1-2H3.
What are the key properties of [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol?
[1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol has a molecular weight of 212.34 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[methylamino-(1-methylpiperidin-4-yl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116958357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).