N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide

C18H26N4O3 — CID 86979582

IUPACN-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide
SMILESCC(C(=O)NC1CC1)N1CCN(C(=O)CCn2ccccc2=O)CC1
InChIInChI=1S/C18H26N4O3/c1-14(18(25)19-15-5-6-15)20-10-12-22(13-11-20)17(24)7-9-21-8-3-2-4-16(21)23/h2-4,8,14-15H,5-7,9-13H2,1H3,(H,19,25)
InChIKeyNAJSRZRDTDBBCC-UHFFFAOYSA-N
MW346.43 g/mol
LogP0.05
Rot. Bonds6

About N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide

N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide (PubChem CID 86979582) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide
PubChem CID86979582
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide
SMILESCC(C(=O)NC1CC1)N1CCN(C(=O)CCn2ccccc2=O)CC1
InChIInChI=1S/C18H26N4O3/c1-14(18(25)19-15-5-6-15)20-10-12-22(13-11-20)17(24)7-9-21-8-3-2-4-16(21)23/h2-4,8,14-15H,5-7,9-13H2,1H3,(H,19,25)
InChIKeyNAJSRZRDTDBBCC-UHFFFAOYSA-N
XLogP0.05
TPSA74.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(3-aminopropanoyl)piperazin-1-yl]-N-cyclopropylpropanamide
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2-[4-(3-aminopropanoyl)piperazin-1-yl]-N-cyclopropylpropanamide;dihydrochloride
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N-cyclopropyl-2-[4-[2-(4-hydroxyphenyl)acetyl]piperazin-1-yl]propanamide
CID 78831379
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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide (CID 86979582) is N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide is CC(C(=O)NC1CC1)N1CCN(C(=O)CCn2ccccc2=O)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide?
The InChIKey is NAJSRZRDTDBBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-14(18(25)19-15-5-6-15)20-10-12-22(13-11-20)17(24)7-9-21-8-3-2-4-16(21)23/h2-4,8,14-15H,5-7,9-13H2,1H3,(H,19,25).
What are the key properties of N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide?
N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide has a molecular weight of 346.43 g/mol, XLogP of 0.05, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[3-(2-oxo-1-pyridinyl)propanoyl]piperazin-1-yl]propanamide is sourced from PubChem (CID 86979582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).