N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide

C14H29N3O — CID 110441171

IUPACN-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide
SMILESCC(=O)NCCCCCN(C)C1CCN(C)CC1
InChIInChI=1S/C14H29N3O/c1-13(18)15-9-5-4-6-10-17(3)14-7-11-16(2)12-8-14/h14H,4-12H2,1-3H3,(H,15,18)
InChIKeyQOHGGIADFKHBAK-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.32
Rot. Bonds7

About N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide

N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide (PubChem CID 110441171) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide.

Molecular Properties

Compound NameN-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide
PubChem CID110441171
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide
SMILESCC(=O)NCCCCCN(C)C1CCN(C)CC1
InChIInChI=1S/C14H29N3O/c1-13(18)15-9-5-4-6-10-17(3)14-7-11-16(2)12-8-14/h14H,4-12H2,1-3H3,(H,15,18)
InChIKeyQOHGGIADFKHBAK-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]cyclopropanecarboxamide
CID 110445585
3-methyl-N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]butanamide
CID 110442144
N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]benzamide
CID 110442921
N-(5-hydroxypentyl)-3-[methyl-(1-methylpiperidin-4-yl)amino]propanamide
CID 110839296
3-[5-[cyclohexyl(methyl)amino]pentyl]-1,1-dimethylurea
CID 110443807
N-[4-(4-methylpiperazin-1-yl)butyl]acetamide
CID 110459248
N-hexyl-N'-methyl-N'-(1-methylpiperidin-4-yl)ethane-1,2-diamine
CID 62574097
ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 145305078
1-[4-[methyl-[3-(methylamino)propyl]amino]piperidin-1-yl]ethanone
CID 70287860
N-(2-hydroxyethyl)-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 43509628
N-(3-methoxypropyl)-N,1-dimethylpiperidin-4-amine
CID 166948035
N-[5-(azepan-1-yl)pentyl]acetamide
CID 110441166

Frequently Asked Questions

What is the IUPAC name of N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide?
The IUPAC name of N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide (CID 110441171) is N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide.
What is the SMILES notation for N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide?
The canonical SMILES for N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide is CC(=O)NCCCCCN(C)C1CCN(C)CC1.
What is the InChIKey of N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide?
The InChIKey is QOHGGIADFKHBAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-13(18)15-9-5-4-6-10-17(3)14-7-11-16(2)12-8-14/h14H,4-12H2,1-3H3,(H,15,18).
What are the key properties of N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide?
N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide has a molecular weight of 255.41 g/mol, XLogP of 1.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[methyl-(1-methylpiperidin-4-yl)amino]pentyl]acetamide is sourced from PubChem (CID 110441171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).