2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide

C15H16Cl2N2O3 — CID 78892227

IUPAC2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C1CC1(Cl)Cl
InChIInChI=1S/C15H16Cl2N2O3/c16-15(17)9-12(15)13(20)18-11-3-1-10(2-4-11)14(21)19-5-7-22-8-6-19/h1-4,12H,5-9H2,(H,18,20)
InChIKeyHEVHHNHHCYTISE-UHFFFAOYSA-N
MW343.21 g/mol
LogP2.29
Rot. Bonds3

About 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide

2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide (PubChem CID 78892227) has the molecular formula C15H16Cl2N2O3 and a molecular weight of 343.21 g/mol. Its IUPAC name is 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
PubChem CID78892227
Molecular FormulaC15H16Cl2N2O3
Molecular Weight343.21 g/mol
Exact Mass342.05
IUPAC Name2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C1CC1(Cl)Cl
InChIInChI=1S/C15H16Cl2N2O3/c16-15(17)9-12(15)13(20)18-11-3-1-10(2-4-11)14(21)19-5-7-22-8-6-19/h1-4,12H,5-9H2,(H,18,20)
InChIKeyHEVHHNHHCYTISE-UHFFFAOYSA-N
XLogP2.29
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.21
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(morpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
CID 3152021
trans-(1S,2S)-2-[[4-(morpholine-4-carbonyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1080146
(1R)-N-(4-acetylphenyl)-2,2-dichlorocyclopropane-1-carboxamide
CID 8712837
(1S,6S)-6-[[4-(morpholine-4-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate
CID 6970208
3,4-dimethyl-6-[[4-(morpholine-4-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate
CID 4139595
N-[4-(morpholine-4-carbonyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119712395
4-methylsulfanyl-N-[4-(morpholine-4-carbonyl)phenyl]benzamide
CID 78892234
N-[4-[4-(2-morpholin-4-yl-2-oxoacetyl)piperazine-1-carbonyl]phenyl]prop-2-enamide
CID 166403525
N-[4-(morpholine-4-carbonyl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 17153816
5-cyclopropyl-N-[4-(morpholine-4-carbonyl)phenyl]pyrazolidine-3-carboxamide
CID 74583245
(2S,5R)-5-(aminomethyl)-N-[4-(morpholine-4-carbonyl)phenyl]oxolane-2-carboxamide
CID 120786426
(3S)-N-[4-(morpholine-4-carbonyl)phenyl]-5-oxo-1,4-thiazepane-3-carboxamide
CID 100816422

Frequently Asked Questions

What is the IUPAC name of 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide (CID 78892227) is 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide is O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C1CC1(Cl)Cl.
What is the InChIKey of 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
The InChIKey is HEVHHNHHCYTISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O3/c16-15(17)9-12(15)13(20)18-11-3-1-10(2-4-11)14(21)19-5-7-22-8-6-19/h1-4,12H,5-9H2,(H,18,20).
What are the key properties of 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide?
2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 343.21 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloro-N-[4-(morpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 78892227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).