N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide

C18H27N3O2 — CID 34188101

IUPACN-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
SMILESO=C(CCN1CCN(CCOc2ccccc2)CC1)NC1CC1
InChIInChI=1S/C18H27N3O2/c22-18(19-16-6-7-16)8-9-20-10-12-21(13-11-20)14-15-23-17-4-2-1-3-5-17/h1-5,16H,6-15H2,(H,19,22)
InChIKeyUTHZWSMFAKERLO-UHFFFAOYSA-N
MW317.43 g/mol
LogP1.35
Rot. Bonds8

About N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide

N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide (PubChem CID 34188101) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
PubChem CID34188101
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC NameN-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
SMILESO=C(CCN1CCN(CCOc2ccccc2)CC1)NC1CC1
InChIInChI=1S/C18H27N3O2/c22-18(19-16-6-7-16)8-9-20-10-12-21(13-11-20)14-15-23-17-4-2-1-3-5-17/h1-5,16H,6-15H2,(H,19,22)
InChIKeyUTHZWSMFAKERLO-UHFFFAOYSA-N
XLogP1.35
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylcyclohexyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 39746892
N-[1-(2-aminoethyl)piperidin-4-yl]-3-phenoxypropanamide
CID 63627698
N-cyclopropyl-2-[4-(3-phenoxypropanoyl)piperazin-1-yl]acetamide
CID 110709703
4-[4-(2-phenoxyethyl)piperazin-1-yl]butanoic acid
CID 119134542
N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-phenoxypropanamide
CID 166191503
3-amino-N-[1-[2-(4-bromophenoxy)ethyl]piperidin-4-yl]propanamide;dihydrochloride
CID 119891190
prop-2-enyl 4-(4-phenoxybutanoylamino)piperidine-1-carboxylate
CID 108561202
ethyl 4-(3-phenoxypropanoylamino)piperidine-1-carboxylate
CID 31542229
3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 56853055
1-cyclohexyl-3-[4-oxo-4-[4-(2-phenoxyethyl)piperazin-1-yl]butyl]urea
CID 16621685
ethane;N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 142596800
N-[1-(3-phenoxypropanoyl)piperidin-4-yl]butanamide
CID 110820896

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide (CID 34188101) is N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide is O=C(CCN1CCN(CCOc2ccccc2)CC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The InChIKey is UTHZWSMFAKERLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c22-18(19-16-6-7-16)8-9-20-10-12-21(13-11-20)14-15-23-17-4-2-1-3-5-17/h1-5,16H,6-15H2,(H,19,22).
What are the key properties of N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide has a molecular weight of 317.43 g/mol, XLogP of 1.35, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 34188101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).