N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide

C14H26N2O2 — CID 79389356

IUPACN-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide
SMILESCCN(CC(=O)N(C)C1=CCCC1)CC(C)(C)O
InChIInChI=1S/C14H26N2O2/c1-5-16(11-14(2,3)18)10-13(17)15(4)12-8-6-7-9-12/h8,18H,5-7,9-11H2,1-4H3
InChIKeyNBISDZJUEHVPEV-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.61
Rot. Bonds6

About N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide

N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide (PubChem CID 79389356) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide.

Molecular Properties

Compound NameN-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide
PubChem CID79389356
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide
SMILESCCN(CC(=O)N(C)C1=CCCC1)CC(C)(C)O
InChIInChI=1S/C14H26N2O2/c1-5-16(11-14(2,3)18)10-13(17)15(4)12-8-6-7-9-12/h8,18H,5-7,9-11H2,1-4H3
InChIKeyNBISDZJUEHVPEV-UHFFFAOYSA-N
XLogP1.61
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide?
The IUPAC name of N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide (CID 79389356) is N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide.
What is the SMILES notation for N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide?
The canonical SMILES for N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide is CCN(CC(=O)N(C)C1=CCCC1)CC(C)(C)O.
What is the InChIKey of N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide?
The InChIKey is NBISDZJUEHVPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-5-16(11-14(2,3)18)10-13(17)15(4)12-8-6-7-9-12/h8,18H,5-7,9-11H2,1-4H3.
What are the key properties of N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide?
N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide has a molecular weight of 254.37 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenten-1-yl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide is sourced from PubChem (CID 79389356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).