1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone

C15H29NO3 — CID 104750189

IUPAC1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone
SMILESCOCCCN(CCOC)CC(=O)C1CCCCC1
InChIInChI=1S/C15H29NO3/c1-18-11-6-9-16(10-12-19-2)13-15(17)14-7-4-3-5-8-14/h14H,3-13H2,1-2H3
InChIKeyJMFIUNPAKVNJGS-UHFFFAOYSA-N
MW271.40 g/mol
LogP2.12
Rot. Bonds10

About 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone

1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone (PubChem CID 104750189) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone.

Molecular Properties

Compound Name1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone
PubChem CID104750189
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC Name1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone
SMILESCOCCCN(CCOC)CC(=O)C1CCCCC1
InChIInChI=1S/C15H29NO3/c1-18-11-6-9-16(10-12-19-2)13-15(17)14-7-4-3-5-8-14/h14H,3-13H2,1-2H3
InChIKeyJMFIUNPAKVNJGS-UHFFFAOYSA-N
XLogP2.12
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-cyclopentyl-2-[2-(3-methoxypropoxy)ethoxy]ethanone
CID 103178926
N-(cyclohexylmethyl)-N'-(2-methoxyethyl)-N'-(3-methoxypropyl)ethane-1,2-diamine
CID 62555270
1-cyclopropyl-2-[cyclopropyl(2-methoxyethyl)amino]ethanone
CID 63914095
N-cyclohexyl-2-[2-hydroxyethyl(2-methoxyethyl)amino]-N-methylacetamide
CID 115613753
2-[2-methoxyethyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]acetic acid
CID 54969053
N-(3-aminopropyl)-N-(2-methoxyethyl)cycloheptanecarboxamide
CID 63287770
2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid
CID 65457394
1-cyclopentyl-2-(3-methoxypropylsulfonyl)ethanone
CID 104756176
2-[(3-amino-3-sulfanylidenepropyl)-(2-methoxyethyl)amino]-N-cyclohexylacetamide
CID 63285116
3-cyclopentyl-N,N-bis(2-methoxyethyl)propan-1-amine
CID 78870866
1-cyclohexyl-2-[cyclopropylmethyl(ethyl)amino]ethanone
CID 104750812
1-cyclopentyl-2-[ethyl(1-methoxypropan-2-yl)amino]ethanone
CID 104750248

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone?
The IUPAC name of 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone (CID 104750189) is 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone.
What is the SMILES notation for 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone?
The canonical SMILES for 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone is COCCCN(CCOC)CC(=O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone?
The InChIKey is JMFIUNPAKVNJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-18-11-6-9-16(10-12-19-2)13-15(17)14-7-4-3-5-8-14/h14H,3-13H2,1-2H3.
What are the key properties of 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone?
1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone has a molecular weight of 271.40 g/mol, XLogP of 2.12, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[2-methoxyethyl(3-methoxypropyl)amino]ethanone is sourced from PubChem (CID 104750189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).