N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide

C14H29N3O — CID 144835640

IUPACN-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide
SMILESCCCCC(=O)NCCCN1CCN(CC)CC1
InChIInChI=1S/C14H29N3O/c1-3-5-7-14(18)15-8-6-9-17-12-10-16(4-2)11-13-17/h3-13H2,1-2H3,(H,15,18)
InChIKeyIESRRJIVODPNKU-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.32
Rot. Bonds8

About N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide

N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide (PubChem CID 144835640) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide.

Molecular Properties

Compound NameN-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide
PubChem CID144835640
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide
SMILESCCCCC(=O)NCCCN1CCN(CC)CC1
InChIInChI=1S/C14H29N3O/c1-3-5-7-14(18)15-8-6-9-17-12-10-16(4-2)11-13-17/h3-13H2,1-2H3,(H,15,18)
InChIKeyIESRRJIVODPNKU-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-3-(4-ethylpiperazin-1-yl)propanamide
CID 109012188
N-[3-[4-[3-(octadecanoylamino)propyl]piperazin-1-yl]propyl]octadecanamide
CID 54494521
3-(dimethylamino)-N-[3-(4-ethylpiperazin-1-yl)propyl]propanamide
CID 110442446
N-(3-pyrrolidin-1-ylpropyl)butanamide
CID 60668593
N-(2-piperidin-1-ylethyl)pentanamide
CID 70962894
N-butyl-3-(4-methylpiperazin-1-yl)propanamide
CID 109012187
ethane;5-(4-methylpiperazin-1-yl)-N-propylpentanamide
CID 176967624
2-(4-ethylpiperazin-1-yl)-N-pentylacetamide
CID 108995511
N-(3-morpholin-4-ylpropyl)butanamide
CID 4162480
N-[4-(4-ethylpiperazin-1-yl)butyl]acetamide
CID 110441162
3-(4-formylpiperazin-1-yl)-N-pentylpropanamide
CID 109017998
2-[7-[2-[[6-(butylamino)-6-oxohexyl]amino]-2-oxoethyl]-4-(carboxymethyl)-10-ethyl-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 171639687

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide?
The IUPAC name of N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide (CID 144835640) is N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide.
What is the SMILES notation for N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide?
The canonical SMILES for N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide is CCCCC(=O)NCCCN1CCN(CC)CC1.
What is the InChIKey of N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide?
The InChIKey is IESRRJIVODPNKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-3-5-7-14(18)15-8-6-9-17-12-10-16(4-2)11-13-17/h3-13H2,1-2H3,(H,15,18).
What are the key properties of N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide?
N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide has a molecular weight of 255.41 g/mol, XLogP of 1.32, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-ethylpiperazin-1-yl)propyl]pentanamide is sourced from PubChem (CID 144835640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).