N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide

C19H20Cl2N4O2 — CID 4645567

IUPACN-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide
SMILESO=C(CCN(C(=O)c1cnccn1)C1CC1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C19H20Cl2N4O2/c20-14-2-1-13(16(21)11-14)5-7-24-18(26)6-10-25(15-3-4-15)19(27)17-12-22-8-9-23-17/h1-2,8-9,11-12,15H,3-7,10H2,(H,24,26)
InChIKeyAUMGHHLCWSXHMA-UHFFFAOYSA-N
MW407.30 g/mol
LogP3.14
Rot. Bonds8

About N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide

N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide (PubChem CID 4645567) has the molecular formula C19H20Cl2N4O2 and a molecular weight of 407.30 g/mol. Its IUPAC name is N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide
PubChem CID4645567
Molecular FormulaC19H20Cl2N4O2
Molecular Weight407.30 g/mol
Exact Mass406.10
IUPAC NameN-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide
SMILESO=C(CCN(C(=O)c1cnccn1)C1CC1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C19H20Cl2N4O2/c20-14-2-1-13(16(21)11-14)5-7-24-18(26)6-10-25(15-3-4-15)19(27)17-12-22-8-9-23-17/h1-2,8-9,11-12,15H,3-7,10H2,(H,24,26)
InChIKeyAUMGHHLCWSXHMA-UHFFFAOYSA-N
XLogP3.14
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-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-[2-(2,4-dichlorophenyl)ethyl]-4-oxo-4-pyridin-3-ylbutanamide
CID 110416767
N-[2-(2,4-dichlorophenyl)ethyl]-3-pyridin-3-ylpropanamide
CID 9269490
4-[2-(2,4-dichlorophenyl)ethylamino]-4-oxobutanoic acid
CID 9151806
N-[2-(2,4-dichlorophenyl)ethyl]pyridine-3-carboxamide
CID 17472910
N-cyclopropyl-N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 3402919
N-[2-(2,4-dichlorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 62211031
N-[2-(2,4-dichlorophenyl)ethyl]-3-(1H-imidazol-5-yl)propanamide
CID 110697902
N-cyclopropyl-N-[3-(dipropylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 42783325
N-[2-(2,4-dichlorophenyl)ethyl]-N'-(pyridin-3-ylmethyl)propanediamide
CID 108947644
N-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]ethyl]pyrazine-2-carboxamide
CID 8990848
N-[2-(2,4-dichlorophenyl)ethylcarbamoyl]cyclopropanecarboxamide
CID 110866286
2-(cyclopropylcarbamoylamino)-N-[2-(2,4-dichlorophenyl)ethyl]acetamide
CID 112995921

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide (CID 4645567) is N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide is O=C(CCN(C(=O)c1cnccn1)C1CC1)NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide?
The InChIKey is AUMGHHLCWSXHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N4O2/c20-14-2-1-13(16(21)11-14)5-7-24-18(26)6-10-25(15-3-4-15)19(27)17-12-22-8-9-23-17/h1-2,8-9,11-12,15H,3-7,10H2,(H,24,26).
What are the key properties of N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide?
N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide has a molecular weight of 407.30 g/mol, XLogP of 3.14, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[3-[2-(2,4-dichlorophenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide is sourced from PubChem (CID 4645567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).