N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide

C18H31N3O2 — CID 71852651

IUPACN-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide
SMILESCCCC1(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)CCC1
InChIInChI=1S/C18H31N3O2/c1-2-7-18(8-3-9-18)17(23)21-13-11-20(12-14-21)10-6-16(22)19-15-4-5-15/h15H,2-14H2,1H3,(H,19,22)
InChIKeyGSDVZPVVVLHFLX-UHFFFAOYSA-N
MW321.47 g/mol
LogP1.77
Rot. Bonds7

About N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide

N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide (PubChem CID 71852651) has the molecular formula C18H31N3O2 and a molecular weight of 321.47 g/mol. Its IUPAC name is N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide
PubChem CID71852651
Molecular FormulaC18H31N3O2
Molecular Weight321.47 g/mol
Exact Mass321.24
IUPAC NameN-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide
SMILESCCCC1(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)CCC1
InChIInChI=1S/C18H31N3O2/c1-2-7-18(8-3-9-18)17(23)21-13-11-20(12-14-21)10-6-16(22)19-15-4-5-15/h15H,2-14H2,1H3,(H,19,22)
InChIKeyGSDVZPVVVLHFLX-UHFFFAOYSA-N
XLogP1.77
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[3-[2-(3-methylpiperidin-1-yl)propylamino]-3-oxopropyl]cyclopropane-1-carboxamide
CID 51081022
N-[1-(5-azaspiro[2.5]octan-5-yl)-1-oxopropan-2-yl]acetamide
CID 86816029
(4S)-N-[(1-ethylcyclobutyl)methyl]-4-(4-methylpiperazin-1-yl)pentanamide
CID 125447972
(4S)-4-(4-methylpiperazin-1-yl)-N-[[1-(2-methylpropyl)cyclobutyl]methyl]pentanamide
CID 164637520
1-[(3S)-4-cyclopentyl-3-methylpiperazine-1-carbonyl]-N-cyclopropylcyclobutane-1-carboxamide
CID 164639674
1-propyl-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)cyclobutane-1-carboxamide
CID 120810679
N-[[4-[(1S,2S)-2-fluorocyclopropanecarbonyl]-1-methylpiperazin-2-yl]methyl]-3-propylhexanamide
CID 166384257
1-acetyl-N-[2-cyclopropyl-2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 75461724
[1-(2-Methylpropyl)cyclobutyl]-piperazin-1-ylmethanone
CID 57700462
1-(2-methylpropyl)-N-piperidin-4-ylcyclobutane-1-carboxamide
CID 57700683
(4-Aminopiperidin-1-yl)-[1-(2-methylpropyl)cyclobutyl]methanone
CID 57700833
7-Azaspiro[3.5]nonan-2-yl-(4-propan-2-yl-1,4-diazepan-1-yl)methanone
CID 59333122

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide (CID 71852651) is N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide is CCCC1(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)CCC1.
What is the InChIKey of N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide?
The InChIKey is GSDVZPVVVLHFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O2/c1-2-7-18(8-3-9-18)17(23)21-13-11-20(12-14-21)10-6-16(22)19-15-4-5-15/h15H,2-14H2,1H3,(H,19,22).
What are the key properties of N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide?
N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide has a molecular weight of 321.47 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[4-(1-propylcyclobutanecarbonyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 71852651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).