3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide

C17H33N3O2 — CID 95934968

IUPAC3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide
SMILESCCN1CCN(CCC(=O)N[C@@H]2C[C@@](C)(OC)C2(C)C)CC1
InChIInChI=1S/C17H33N3O2/c1-6-19-9-11-20(12-10-19)8-7-15(21)18-14-13-17(4,22-5)16(14,2)3/h14H,6-13H2,1-5H3,(H,18,21)/t14-,17-/m1/s1
InChIKeyGZPYWWDYGRDCBE-RHSMWYFYSA-N
MW311.47 g/mol
LogP1.33
Rot. Bonds6

About 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide

3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide (PubChem CID 95934968) has the molecular formula C17H33N3O2 and a molecular weight of 311.47 g/mol. Its IUPAC name is 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide.

Molecular Properties

Compound Name3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide
PubChem CID95934968
Molecular FormulaC17H33N3O2
Molecular Weight311.47 g/mol
Exact Mass311.26
IUPAC Name3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide
SMILESCCN1CCN(CCC(=O)N[C@@H]2C[C@@](C)(OC)C2(C)C)CC1
InChIInChI=1S/C17H33N3O2/c1-6-19-9-11-20(12-10-19)8-7-15(21)18-14-13-17(4,22-5)16(14,2)3/h14H,6-13H2,1-5H3,(H,18,21)/t14-,17-/m1/s1
InChIKeyGZPYWWDYGRDCBE-RHSMWYFYSA-N
XLogP1.33
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.47
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide with MolForge

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Related Compounds

N-(3-methoxy-2,2,3-trimethylcyclobutyl)-4-(methylamino)butanamide;hydrochloride
CID 119817936
N-[4-[[(1R,3S)-3-methoxy-2,2,3-trimethylcyclobutyl]amino]-4-oxobutyl]cyclopropanecarboxamide
CID 95906540
N-[(1R,3S)-3-methoxy-2,2,3-trimethylcyclobutyl]-4-pyridin-2-ylbutanamide
CID 95906524
(2R)-N-[(1R,3S)-3-methoxy-2,2,3-trimethylcyclobutyl]-2-(2-oxopyrrolidin-1-yl)butanamide
CID 129428982
3-(4-ethylpiperazin-1-yl)-N-(3-methylbut-2-en-2-yl)propanamide
CID 123304936
2-[ethyl-[1-[(3-methoxy-2,2,3-trimethylcyclobutyl)carbamoyl]piperidin-4-yl]amino]acetic acid
CID 122004604
1-[(1R,3S)-3-methoxy-2,2,3-trimethylcyclobutyl]-3-(3-pyrazol-1-ylpropyl)urea
CID 95909004
4-(4-ethylpiperazin-1-yl)butan-2-one
CID 20802873
N-butyl-3-(4-ethylpiperazin-1-yl)propanamide
CID 109012188
ethyl 4-[3-(cyclopropylamino)-3-oxopropyl]piperazine-1-carboxylate
CID 51077572
5-[(3-methoxy-2,2,3-trimethylcyclobutyl)carbamoyl]thiophene-2-carboxylic acid
CID 119187199
N-cyclopropyl-3-(4-methylpiperidin-1-yl)propanamide
CID 109011725

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide?
The IUPAC name of 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide (CID 95934968) is 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide.
What is the SMILES notation for 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide?
The canonical SMILES for 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide is CCN1CCN(CCC(=O)N[C@@H]2C[C@@](C)(OC)C2(C)C)CC1.
What is the InChIKey of 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide?
The InChIKey is GZPYWWDYGRDCBE-RHSMWYFYSA-N. The full InChI is InChI=1S/C17H33N3O2/c1-6-19-9-11-20(12-10-19)8-7-15(21)18-14-13-17(4,22-5)16(14,2)3/h14H,6-13H2,1-5H3,(H,18,21)/t14-,17-/m1/s1.
What are the key properties of 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide?
3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide has a molecular weight of 311.47 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylpiperazin-1-yl)-N-[(1R,3R)-3-methoxy-2,2,3-trimethylcyclobutyl]propanamide is sourced from PubChem (CID 95934968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).