N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide

C14H24N4O — CID 62691425

IUPACN-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)NCCCCn1ccnc1
InChIInChI=1S/C14H24N4O/c19-14(10-13-4-3-5-15-11-13)17-6-1-2-8-18-9-7-16-12-18/h7,9,12-13,15H,1-6,8,10-11H2,(H,17,19)
InChIKeySIVGPOGEGFYNJH-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.17
Rot. Bonds7

About N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide

N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide (PubChem CID 62691425) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide
PubChem CID62691425
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)NCCCCn1ccnc1
InChIInChI=1S/C14H24N4O/c19-14(10-13-4-3-5-15-11-13)17-6-1-2-8-18-9-7-16-12-18/h7,9,12-13,15H,1-6,8,10-11H2,(H,17,19)
InChIKeySIVGPOGEGFYNJH-UHFFFAOYSA-N
XLogP1.17
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-imidazol-1-yl-N-(piperidin-3-ylmethyl)butan-1-amine
CID 80555259
2-imidazol-1-yl-N-(piperidin-3-ylmethyl)ethanamine
CID 80555335
N-(3-imidazol-1-ylpropyl)-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119827227
N-(3-imidazol-1-ylpropyl)-2-(oxolan-3-yl)acetamide
CID 119068889
N-(3-imidazol-1-ylpropyl)pyrrolidine-2-carboxamide
CID 43112147
2-(1,1-dioxo-1,4-thiazinan-3-yl)-N-(4-imidazol-1-ylbutyl)acetamide
CID 80518226
2-chloro-N-(4-imidazol-1-ylbutyl)acetamide;hydrochloride
CID 146083026
N-ethyl-3-imidazol-1-yl-N-(piperidin-3-ylmethyl)propanamide
CID 106629654
N-(2-hydroxyethyl)-2-piperidin-3-ylacetamide
CID 22929447
2-(azetidin-3-yl)-N-(4-imidazol-1-ylbutyl)propanamide
CID 116677559
N-(3-imidazol-1-ylpropyl)-3-piperidin-2-ylpropanamide
CID 62210335
3-cyclopentyl-N-(2-imidazol-1-ylethyl)propanamide
CID 47020069

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide?
The IUPAC name of N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide (CID 62691425) is N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide?
The canonical SMILES for N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide is O=C(CC1CCCNC1)NCCCCn1ccnc1.
What is the InChIKey of N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide?
The InChIKey is SIVGPOGEGFYNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c19-14(10-13-4-3-5-15-11-13)17-6-1-2-8-18-9-7-16-12-18/h7,9,12-13,15H,1-6,8,10-11H2,(H,17,19).
What are the key properties of N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide?
N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide has a molecular weight of 264.37 g/mol, XLogP of 1.17, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylbutyl)-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62691425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).