ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate

C15H28N2O3 — CID 112544046

IUPACethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate
SMILESCCOC(=O)NC1CC(C(C)O)CN(C2CCC2C)C1
InChIInChI=1S/C15H28N2O3/c1-4-20-15(19)16-13-7-12(11(3)18)8-17(9-13)14-6-5-10(14)2/h10-14,18H,4-9H2,1-3H3,(H,16,19)
InChIKeyORLLHNPQUGYGIZ-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.60
Rot. Bonds4

About ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate

ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate (PubChem CID 112544046) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate.

Molecular Properties

Compound Nameethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate
PubChem CID112544046
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Nameethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate
SMILESCCOC(=O)NC1CC(C(C)O)CN(C2CCC2C)C1
InChIInChI=1S/C15H28N2O3/c1-4-20-15(19)16-13-7-12(11(3)18)8-17(9-13)14-6-5-10(14)2/h10-14,18H,4-9H2,1-3H3,(H,16,19)
InChIKeyORLLHNPQUGYGIZ-UHFFFAOYSA-N
XLogP1.60
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate
CID 112543405
ethyl N-[5-butyl-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate
CID 112544038
ethyl 3-(ethoxycarbonylamino)-5-(1-hydroxyethyl)piperidine-1-carboxylate
CID 112543799
ethyl N-[5-(1-hydroxyethyl)-1-(2-methylpropyl)piperidin-3-yl]carbamate
CID 112543725
N-[5-ethyl-1-(2-methylcyclobutyl)piperidin-3-yl]-2-methylpropanamide
CID 112542854
1-[5-(cyclopropylmethylamino)-1-(2-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 83996673
ethyl N-[1-(cyclopropylmethyl)-5-propan-2-ylpiperidin-3-yl]carbamate
CID 112544052
ethyl N-[5-(cyclopropylmethyl)-1-(3-methylcyclobutyl)piperidin-3-yl]carbamate
CID 112544027
N-[1-(2-methylcyclobutyl)-5-propylpiperidin-3-yl]acetamide
CID 112541963
ethyl N-(1-cyclopentyl-5-propylpiperidin-3-yl)carbamate
CID 112543963
ethyl N-(5-butyl-1-cyclopentylpiperidin-3-yl)carbamate
CID 112543964
methyl 3-[3-(ethoxycarbonylamino)-5-propan-2-ylpiperidin-1-yl]propanoate
CID 112544128

Frequently Asked Questions

What is the IUPAC name of ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate?
The IUPAC name of ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate (CID 112544046) is ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate.
What is the SMILES notation for ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate?
The canonical SMILES for ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate is CCOC(=O)NC1CC(C(C)O)CN(C2CCC2C)C1.
What is the InChIKey of ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate?
The InChIKey is ORLLHNPQUGYGIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-4-20-15(19)16-13-7-12(11(3)18)8-17(9-13)14-6-5-10(14)2/h10-14,18H,4-9H2,1-3H3,(H,16,19).
What are the key properties of ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate?
ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate has a molecular weight of 284.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[5-(1-hydroxyethyl)-1-(2-methylcyclobutyl)piperidin-3-yl]carbamate is sourced from PubChem (CID 112544046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).