N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide

C19H25N3O3 — CID 31932540

IUPACN-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
SMILESCC(=O)c1ccc(NC(=O)CCN2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C19H25N3O3/c1-14(23)15-4-6-17(7-5-15)20-18(24)8-9-21-10-12-22(13-11-21)19(25)16-2-3-16/h4-7,16H,2-3,8-13H2,1H3,(H,20,24)
InChIKeyLRQGCINDURLCFD-UHFFFAOYSA-N
MW343.43 g/mol
LogP1.77
Rot. Bonds6

About N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide

N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide (PubChem CID 31932540) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
PubChem CID31932540
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
SMILESCC(=O)c1ccc(NC(=O)CCN2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C19H25N3O3/c1-14(23)15-4-6-17(7-5-15)20-18(24)8-9-21-10-12-22(13-11-21)19(25)16-2-3-16/h4-7,16H,2-3,8-13H2,1H3,(H,20,24)
InChIKeyLRQGCINDURLCFD-UHFFFAOYSA-N
XLogP1.77
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 155569851
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1-[3-(4-acetylanilino)-3-oxopropyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
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N-(4-acetylphenyl)-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
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N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
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N-(4-acetylphenyl)-3-(2,6-dimethylmorpholin-4-yl)propanamide
CID 24588538
3-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 31932591
3-(4-acetylpiperazin-1-yl)-N-(4-ethylphenyl)propanamide
CID 109018341
ethyl 4-[3-(4-ethoxycarbonylanilino)-3-oxopropyl]piperazine-1-carboxylate
CID 109029191
N-(4-acetylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196979
3-(4-acetylpiperazin-1-yl)-N-(4-cyanophenyl)propanamide
CID 28793141
4-(3-pyrrolidin-1-ylpropanoylamino)benzamide
CID 110688218

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide (CID 31932540) is N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide is CC(=O)c1ccc(NC(=O)CCN2CCN(C(=O)C3CC3)CC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide?
The InChIKey is LRQGCINDURLCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14(23)15-4-6-17(7-5-15)20-18(24)8-9-21-10-12-22(13-11-21)19(25)16-2-3-16/h4-7,16H,2-3,8-13H2,1H3,(H,20,24).
What are the key properties of N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide?
N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide has a molecular weight of 343.43 g/mol, XLogP of 1.77, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 31932540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).