N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide

C14H21N3O2 — CID 6457755

IUPACN-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCN(CCO)CC1
InChIInChI=1S/C14H21N3O2/c18-11-10-16-6-8-17(9-7-16)14(19)15-12-13-4-2-1-3-5-13/h1-5,18H,6-12H2,(H,15,19)
InChIKeyFQFDKBAIDHOSEC-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.51
Rot. Bonds4

About N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide

N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide (PubChem CID 6457755) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide
PubChem CID6457755
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide
SMILESO=C(NCc1ccccc1)N1CCN(CCO)CC1
InChIInChI=1S/C14H21N3O2/c18-11-10-16-6-8-17(9-7-16)14(19)15-12-13-4-2-1-3-5-13/h1-5,18H,6-12H2,(H,15,19)
InChIKeyFQFDKBAIDHOSEC-UHFFFAOYSA-N
XLogP0.51
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Morpholineacetamide, N-(phenylmethyl)-
CID 2958814
N-benzylpiperazine-1-carboxamide hydrochloride
CID 17400262
N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide
CID 2815672
N-benzyl-4-cyclopentylpiperazine-1-carboxamide
CID 40012125
N-benzyl-N-methylmorpholine-4-carboxamide
CID 669645
N-benzylmorpholine-4-carboxamide
CID 760018
N-benzyl-4-ethylpiperazine-1-carboxamide
CID 858176
N-(3-phenylpropyl)morpholine-4-carboxamide
CID 1973120
N-(diphenylmethyl)morpholin-4-ylcarboxamide
CID 1538456
N-(1-phenylethyl)morpholine-4-carboxamide
CID 3136314
N-benzylpiperidine-1-carboxamide
CID 2987569
1-Benzyl-1,3-diazinan-2-one
CID 13404971

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The IUPAC name of N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide (CID 6457755) is N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The canonical SMILES for N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide is O=C(NCc1ccccc1)N1CCN(CCO)CC1.
What is the InChIKey of N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The InChIKey is FQFDKBAIDHOSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c18-11-10-16-6-8-17(9-7-16)14(19)15-12-13-4-2-1-3-5-13/h1-5,18H,6-12H2,(H,15,19).
What are the key properties of N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide?
N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(2-hydroxyethyl)piperazine-1-carboxamide is sourced from PubChem (CID 6457755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).