2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate

C14H20N2O3 — CID 79349659

IUPAC2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate
SMILESO=C(Nc1ccc(N2CCCCC2)cc1)OCCO
InChIInChI=1S/C14H20N2O3/c17-10-11-19-14(18)15-12-4-6-13(7-5-12)16-8-2-1-3-9-16/h4-7,17H,1-3,8-11H2,(H,15,18)
InChIKeyFPZDSDWRCMHPAM-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.22
Rot. Bonds4

About 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate

2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate (PubChem CID 79349659) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate
PubChem CID79349659
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate
SMILESO=C(Nc1ccc(N2CCCCC2)cc1)OCCO
InChIInChI=1S/C14H20N2O3/c17-10-11-19-14(18)15-12-4-6-13(7-5-12)16-8-2-1-3-9-16/h4-7,17H,1-3,8-11H2,(H,15,18)
InChIKeyFPZDSDWRCMHPAM-UHFFFAOYSA-N
XLogP2.22
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-hydroxyethyl N-(3-pyrrolidin-1-ylphenyl)carbamate
CID 79345921
methyl N-[4-(4-piperidin-1-ylanilino)phenyl]carbamate
CID 112988794
2-(2-aminoethoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 79473221
(4-pyrrolidin-1-ylphenyl)carbamic acid
CID 91209465
5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide
CID 79199227
N-(4-pyrrolidin-1-ylphenyl)azepane-1-carboxamide
CID 108991070
2-bromo-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 63680073
1-amino-N-[4-(azepan-1-yl)phenyl]cyclopropane-1-carboxamide
CID 65463655
N-[4-(azepan-1-yl)phenyl]butanamide
CID 60593025
(2R)-2-amino-N-(4-piperidin-1-ylphenyl)propanamide
CID 54996178
1-ethyl-3-(4-piperidin-1-ylphenyl)urea
CID 108890460
(2S)-2-amino-N-[4-(azepan-1-yl)phenyl]butanamide
CID 79022944

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate?
The IUPAC name of 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate (CID 79349659) is 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate.
What is the SMILES notation for 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate?
The canonical SMILES for 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate is O=C(Nc1ccc(N2CCCCC2)cc1)OCCO.
What is the InChIKey of 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate?
The InChIKey is FPZDSDWRCMHPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-10-11-19-14(18)15-12-4-6-13(7-5-12)16-8-2-1-3-9-16/h4-7,17H,1-3,8-11H2,(H,15,18).
What are the key properties of 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate?
2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate has a molecular weight of 264.32 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-(4-piperidin-1-ylphenyl)carbamate is sourced from PubChem (CID 79349659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).