2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide

C24H30N4O3 — CID 86955156

IUPAC2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide
SMILESCC(C(N)=O)N1CCN(C(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)CC1
InChIInChI=1S/C24H30N4O3/c1-17(22(25)29)26-13-15-28(16-14-26)23(30)19-9-11-27(12-10-19)24(31)21-8-4-6-18-5-2-3-7-20(18)21/h2-8,17,19H,9-16H2,1H3,(H2,25,29)
InChIKeyZQXKRXLVNRPZRR-UHFFFAOYSA-N
MW422.53 g/mol
LogP1.71
Rot. Bonds4

About 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide

2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide (PubChem CID 86955156) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide.

Molecular Properties

Compound Name2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide
PubChem CID86955156
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC Name2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide
SMILESCC(C(N)=O)N1CCN(C(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)CC1
InChIInChI=1S/C24H30N4O3/c1-17(22(25)29)26-13-15-28(16-14-26)23(30)19-9-11-27(12-10-19)24(31)21-8-4-6-18-5-2-3-7-20(18)21/h2-8,17,19H,9-16H2,1H3,(H2,25,29)
InChIKeyZQXKRXLVNRPZRR-UHFFFAOYSA-N
XLogP1.71
TPSA86.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

azepan-1-yl-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 27659108
morpholin-4-yl-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 17400895
(3,5-dimethylpiperidin-1-yl)-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 51239988
[3-(1-aminoethyl)piperidin-1-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone;hydrochloride
CID 119593361
[3-(aminomethyl)pyrrolidin-1-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 119483891
[4-(2-fluorophenyl)piperazin-1-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 34229652
2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide
CID 46568132
[(2S)-2-methylmorpholin-4-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 42002042
(2-methylmorpholin-4-yl)-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 47016285
1-[1-(naphthalene-1-carbonyl)piperidine-3-carbonyl]piperidine-4-carboxamide
CID 51239998
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 120655609
[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 146086866

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide?
The IUPAC name of 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide (CID 86955156) is 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide.
What is the SMILES notation for 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide?
The canonical SMILES for 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide is CC(C(N)=O)N1CCN(C(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)CC1.
What is the InChIKey of 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide?
The InChIKey is ZQXKRXLVNRPZRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c1-17(22(25)29)26-13-15-28(16-14-26)23(30)19-9-11-27(12-10-19)24(31)21-8-4-6-18-5-2-3-7-20(18)21/h2-8,17,19H,9-16H2,1H3,(H2,25,29).
What are the key properties of 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide?
2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide has a molecular weight of 422.53 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide is sourced from PubChem (CID 86955156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).