N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide

C18H35N3O5 — CID 10177369

IUPACN-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide
SMILESCOCCOCCOCC(=O)N1CCCCC1C(=O)NCCCCCN
InChIInChI=1S/C18H35N3O5/c1-24-11-12-25-13-14-26-15-17(22)21-10-6-3-7-16(21)18(23)20-9-5-2-4-8-19/h16H,2-15,19H2,1H3,(H,20,23)
InChIKeyIHZADMKAMSNMBH-UHFFFAOYSA-N
MW373.49 g/mol
LogP0.29
Rot. Bonds14

About N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide

N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide (PubChem CID 10177369) has the molecular formula C18H35N3O5 and a molecular weight of 373.49 g/mol. Its IUPAC name is N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide
PubChem CID10177369
Molecular FormulaC18H35N3O5
Molecular Weight373.49 g/mol
Exact Mass373.26
IUPAC NameN-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide
SMILESCOCCOCCOCC(=O)N1CCCCC1C(=O)NCCCCCN
InChIInChI=1S/C18H35N3O5/c1-24-11-12-25-13-14-26-15-17(22)21-10-6-3-7-16(21)18(23)20-9-5-2-4-8-19/h16H,2-15,19H2,1H3,(H,20,23)
InChIKeyIHZADMKAMSNMBH-UHFFFAOYSA-N
XLogP0.29
TPSA103.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.49
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-butoxy-N-[(3S)-1-(2-morpholin-4-ylethyl)-2-oxopiperidin-3-yl]acetamide
CID 97347967
N-[(5R)-5-(butylamino)-6-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-6-oxohexyl]carbamoyl fluoride
CID 168105207
diacetyl-L-lys-D-ala-D-lac
CID 78480651
Ac-Lys(N3)-AEEA-Gly-Lys(N3)-Gly-Lys-NH2
CID 156595617
3-[1-(N-acetyl-L-leucyl)-4-piperidinyl]-N-(2-methoxyethyl)propanamide
CID 42288345
N-[2-(diethylamino)-1-[1-(2-methoxyacetyl)piperidin-4-yl]-2-oxoethyl]-3-methylbutanamide
CID 46032231
N-(7-aminoheptyl)-2-[[2-[2-(2-methoxyethoxy)ethoxy]acetyl]-methylamino]-3-methylbutanamide
CID 10111800
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]pyrrolidine-2-carboxamide
CID 10111922
N-(6-aminohexyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]pyrrolidine-2-carboxamide
CID 10133948
N-(5-aminopentyl)-2-[[2-[2-(2-methoxyethoxy)ethoxy]acetyl]-methylamino]-3-methylbutanamide
CID 10134065
N-(7-aminoheptyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide
CID 10179195
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide
CID 10180374

Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide?
The IUPAC name of N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide (CID 10177369) is N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide.
What is the SMILES notation for N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide?
The canonical SMILES for N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide is COCCOCCOCC(=O)N1CCCCC1C(=O)NCCCCCN.
What is the InChIKey of N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide?
The InChIKey is IHZADMKAMSNMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O5/c1-24-11-12-25-13-14-26-15-17(22)21-10-6-3-7-16(21)18(23)20-9-5-2-4-8-19/h16H,2-15,19H2,1H3,(H,20,23).
What are the key properties of N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide?
N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide has a molecular weight of 373.49 g/mol, XLogP of 0.29, 14 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]acetyl]piperidine-2-carboxamide is sourced from PubChem (CID 10177369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).