2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol

C16H30N2O — CID 83996660

IUPAC2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol
SMILESCC1CC(N2CC(CCO)CC(NCC3CC3)C2)C1
InChIInChI=1S/C16H30N2O/c1-12-6-16(7-12)18-10-14(4-5-19)8-15(11-18)17-9-13-2-3-13/h12-17,19H,2-11H2,1H3
InChIKeyYMXWKVHNTSWYFK-UHFFFAOYSA-N
MW266.43 g/mol
LogP1.86
Rot. Bonds6

About 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol

2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol (PubChem CID 83996660) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol
PubChem CID83996660
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol
SMILESCC1CC(N2CC(CCO)CC(NCC3CC3)C2)C1
InChIInChI=1S/C16H30N2O/c1-12-6-16(7-12)18-10-14(4-5-19)8-15(11-18)17-9-13-2-3-13/h12-17,19H,2-11H2,1H3
InChIKeyYMXWKVHNTSWYFK-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(cyclohexylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83998736
2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
CID 83997337
N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1-(3-methylcyclobutyl)piperidin-3-amine
CID 83997348
2-[5-(3-methylbutylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol
CID 83995969
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
1-[5-(cyclobutylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 112541490
3-[5-(cyclohexylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83999427
3-[1-cyclobutyl-5-(cyclopentylmethylamino)piperidin-3-yl]propanoic acid
CID 83998032
2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
CID 83989863
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328
3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
CID 83996265
2-[5-(cyclohexylmethylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
CID 83998440

Frequently Asked Questions

What is the IUPAC name of 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol?
The IUPAC name of 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol (CID 83996660) is 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol is CC1CC(N2CC(CCO)CC(NCC3CC3)C2)C1.
What is the InChIKey of 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol?
The InChIKey is YMXWKVHNTSWYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12-6-16(7-12)18-10-14(4-5-19)8-15(11-18)17-9-13-2-3-13/h12-17,19H,2-11H2,1H3.
What are the key properties of 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol?
2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol has a molecular weight of 266.43 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(cyclopropylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]ethanol is sourced from PubChem (CID 83996660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).