4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide

C17H24Cl2N4O2 — CID 113106095

IUPAC4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
SMILESO=C(NCCN1CCOCC1)N1CCN(c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C17H24Cl2N4O2/c18-14-11-15(19)13-16(12-14)22-3-5-23(6-4-22)17(24)20-1-2-21-7-9-25-10-8-21/h11-13H,1-10H2,(H,20,24)
InChIKeyDSNBJOYKSBVDHQ-UHFFFAOYSA-N
MW387.31 g/mol
LogP2.16
Rot. Bonds4

About 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide

4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide (PubChem CID 113106095) has the molecular formula C17H24Cl2N4O2 and a molecular weight of 387.31 g/mol. Its IUPAC name is 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
PubChem CID113106095
Molecular FormulaC17H24Cl2N4O2
Molecular Weight387.31 g/mol
Exact Mass386.13
IUPAC Name4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
SMILESO=C(NCCN1CCOCC1)N1CCN(c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C17H24Cl2N4O2/c18-14-11-15(19)13-16(12-14)22-3-5-23(6-4-22)17(24)20-1-2-21-7-9-25-10-8-21/h11-13H,1-10H2,(H,20,24)
InChIKeyDSNBJOYKSBVDHQ-UHFFFAOYSA-N
XLogP2.16
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-morpholin-4-ylethyl)-4-(4-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide
CID 113106083
4-(4-chloro-2-methylphenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113106058
N-(3-morpholin-4-ylpropyl)-4-phenylpiperazine-1-carboxamide
CID 14763453
4-(3-chlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carbothioamide
CID 4518994
N'-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)propanediamide
CID 108944127
N'-(2-morpholin-4-ylethyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]oxamide
CID 29344676
4-(4-chlorophenyl)-N-(3-piperidin-1-ylpropyl)piperazine-1-carboxamide
CID 11574139
cis-(1R,2S)-2-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 96564729
trans-(1S,2S)-2-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 96564727
cis-(1S,2R)-2-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 96564726
N-butyl-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113103857
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide?
The IUPAC name of 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide (CID 113106095) is 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide is O=C(NCCN1CCOCC1)N1CCN(c2cc(Cl)cc(Cl)c2)CC1.
What is the InChIKey of 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide?
The InChIKey is DSNBJOYKSBVDHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24Cl2N4O2/c18-14-11-15(19)13-16(12-14)22-3-5-23(6-4-22)17(24)20-1-2-21-7-9-25-10-8-21/h11-13H,1-10H2,(H,20,24).
What are the key properties of 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide?
4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide has a molecular weight of 387.31 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)piperazine-1-carboxamide is sourced from PubChem (CID 113106095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).