N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide

C15H26N2O2 — CID 63869968

IUPACN-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide
SMILESNC1CCC(OCCNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C15H26N2O2/c16-13-5-7-14(8-6-13)19-10-9-17-15(18)11-12-3-1-2-4-12/h1,3,12-14H,2,4-11,16H2,(H,17,18)
InChIKeyHPAJNAPQYVOILO-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.75
Rot. Bonds6

About N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide

N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide (PubChem CID 63869968) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide.

Molecular Properties

Compound NameN-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide
PubChem CID63869968
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide
SMILESNC1CCC(OCCNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C15H26N2O2/c16-13-5-7-14(8-6-13)19-10-9-17-15(18)11-12-3-1-2-4-12/h1,3,12-14H,2,4-11,16H2,(H,17,18)
InChIKeyHPAJNAPQYVOILO-UHFFFAOYSA-N
XLogP1.75
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide
CID 62268451
N-[2-(4-aminocyclohexyl)oxyethyl]-2-(oxolan-2-yl)acetamide
CID 65160094
2-(2-aminocyclohexyl)-N-(2-cyclohexyloxyethyl)acetamide
CID 63834168
N-[2-(4-aminocyclohexyl)oxyethyl]-2,2-difluoroacetamide
CID 103514165
N-[2-(4-aminocyclohexyl)oxyethyl]-2-methylbutanamide
CID 63869286
2-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]ethylsulfanyl]acetic acid
CID 115731474
N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]-2-cyclopent-2-en-1-ylacetamide
CID 75380874
N-[2-(4-aminocyclohexyl)oxyethyl]-3,5-dihydroxybenzamide
CID 107704978
N-(2-cyclohexyloxyethyl)-2-(cyclopropylmethylamino)acetamide
CID 63826704
1-[2-(4-aminocyclohexyl)oxyethyl]-3-phenylurea
CID 63869416
2-[[2-(4-aminocyclohexyl)acetyl]amino]ethyl carbamate
CID 83215436
N-[2-(4-aminocyclohexyl)oxyethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 63869969

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide?
The IUPAC name of N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide (CID 63869968) is N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide.
What is the SMILES notation for N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide?
The canonical SMILES for N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide is NC1CCC(OCCNC(=O)CC2C=CCC2)CC1.
What is the InChIKey of N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide?
The InChIKey is HPAJNAPQYVOILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c16-13-5-7-14(8-6-13)19-10-9-17-15(18)11-12-3-1-2-4-12/h1,3,12-14H,2,4-11,16H2,(H,17,18).
What are the key properties of N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide?
N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide has a molecular weight of 266.38 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide is sourced from PubChem (CID 63869968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).