benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate

C15H22N2O3 — CID 171068971

IUPACbenzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate
SMILESO=C(OCc1ccccc1)N(CCO)C1CCNCC1
InChIInChI=1S/C15H22N2O3/c18-11-10-17(14-6-8-16-9-7-14)15(19)20-12-13-4-2-1-3-5-13/h1-5,14,16,18H,6-12H2
InChIKeyXMAGPGJFZXZSTO-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.37
Rot. Bonds5

About benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate

benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate (PubChem CID 171068971) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Namebenzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate
PubChem CID171068971
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Namebenzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate
SMILESO=C(OCc1ccccc1)N(CCO)C1CCNCC1
InChIInChI=1S/C15H22N2O3/c18-11-10-17(14-6-8-16-9-7-14)15(19)20-12-13-4-2-1-3-5-13/h1-5,14,16,18H,6-12H2
InChIKeyXMAGPGJFZXZSTO-UHFFFAOYSA-N
XLogP1.37
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

benzyl N-cyclopropyl-N-propylcarbamate
CID 130159300
benzyl N-butan-2-yl-N-piperidin-4-ylcarbamate
CID 18677686
benzyl N-methyl-N-piperidin-4-ylcarbamate;2,2,2-trifluoroacetic acid
CID 118077491
benzyl N,N-bis(2-hydroxyethyl)carbamate
CID 23498447
benzyl(piperidin-4-yl)carbamic acid
CID 54298382
(2R)-3-oxo-3-phenylmethoxy-2-[phenylmethoxycarbonyl(pyrrolidin-3-yl)amino]propanoic acid
CID 68577473
benzyl N-benzyl-N-(3-fluoropiperidin-4-yl)carbamate
CID 68612218
benzyl piperidine-4-carboxylate;ethanol
CID 158740080
(3,5-difluorophenyl)methyl N-piperidin-4-yl-N-propylcarbamate
CID 18677668
(3,4-difluorophenyl)methyl N-piperidin-4-yl-N-propylcarbamate
CID 18677719
tert-butyl 4-[3-hydroxypropyl(phenylmethoxycarbonyl)amino]piperidine-1-carboxylate
CID 22894079
benzyl N-cyclopropyl-N-[(3S)-piperidin-3-yl]carbamate
CID 66569398

Frequently Asked Questions

What is the IUPAC name of benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate?
The IUPAC name of benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate (CID 171068971) is benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate.
What is the SMILES notation for benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate?
The canonical SMILES for benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate is O=C(OCc1ccccc1)N(CCO)C1CCNCC1.
What is the InChIKey of benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate?
The InChIKey is XMAGPGJFZXZSTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c18-11-10-17(14-6-8-16-9-7-14)15(19)20-12-13-4-2-1-3-5-13/h1-5,14,16,18H,6-12H2.
What are the key properties of benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate?
benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate has a molecular weight of 278.35 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(2-hydroxyethyl)-N-piperidin-4-ylcarbamate is sourced from PubChem (CID 171068971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).