N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide

C18H30N4O2 — CID 39151053

IUPACN-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide
SMILESCC1CCN(c2ccc(=O)n(CCCCC(=O)NCCN)c2)CC1
InChIInChI=1S/C18H30N4O2/c1-15-7-12-21(13-8-15)16-5-6-18(24)22(14-16)11-3-2-4-17(23)20-10-9-19/h5-6,14-15H,2-4,7-13,19H2,1H3,(H,20,23)
InChIKeyCAMDUPJROCJCMI-UHFFFAOYSA-N
MW334.46 g/mol
LogP1.33
Rot. Bonds8

About N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide

N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide (PubChem CID 39151053) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide
PubChem CID39151053
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC NameN-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide
SMILESCC1CCN(c2ccc(=O)n(CCCCC(=O)NCCN)c2)CC1
InChIInChI=1S/C18H30N4O2/c1-15-7-12-21(13-8-15)16-5-6-18(24)22(14-16)11-3-2-4-17(23)20-10-9-19/h5-6,14-15H,2-4,7-13,19H2,1H3,(H,20,23)
InChIKeyCAMDUPJROCJCMI-UHFFFAOYSA-N
XLogP1.33
TPSA80.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(2-aminoethyl)-5-(4-methylpiperidin-1-yl)pyridin-2-one
CID 82032054
2-[3-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]propanoylamino]butanoic acid
CID 82031284
1-[[4-(aminomethyl)phenyl]methyl]-5-(4-methylpiperidin-1-yl)pyridin-2-one
CID 94758177
N-(2-aminoethyl)-3-(5-bromo-2-oxo-1-pyridinyl)propanamide
CID 82031748
N-(2-aminoethyl)-4-(2-oxo-1-pyridinyl)butanamide
CID 82031758
4-amino-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]butanamide
CID 82034911
4-[5-(azepan-1-yl)-2-oxo-1-pyridinyl]butanoic acid
CID 39151147
4-[5-(5-chloro-2-oxo-1-pyridinyl)pentanoylamino]butanoic acid
CID 92941117
5-chloro-N-[4-(4-methylpiperidin-1-yl)phenyl]pentanamide
CID 43346973
3-[N-acetyl-4-(4-methylpiperidin-1-yl)anilino]-N-[2-(dimethylamino)ethyl]propanamide
CID 113132121
7-amino-N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]heptanamide;dihydrochloride
CID 119845060
3-[4-(4-methylpiperidin-1-yl)-N-methylsulfonylanilino]-N-propylpropanamide
CID 113145831

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide?
The IUPAC name of N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide (CID 39151053) is N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide.
What is the SMILES notation for N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide?
The canonical SMILES for N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide is CC1CCN(c2ccc(=O)n(CCCCC(=O)NCCN)c2)CC1.
What is the InChIKey of N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide?
The InChIKey is CAMDUPJROCJCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-15-7-12-21(13-8-15)16-5-6-18(24)22(14-16)11-3-2-4-17(23)20-10-9-19/h5-6,14-15H,2-4,7-13,19H2,1H3,(H,20,23).
What are the key properties of N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide?
N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide has a molecular weight of 334.46 g/mol, XLogP of 1.33, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-5-[5-(4-methylpiperidin-1-yl)-2-oxo-1-pyridinyl]pentanamide is sourced from PubChem (CID 39151053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).