2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide

C14H26N2O — CID 43224493

IUPAC2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCC2CCCCC2C1
InChIInChI=1S/C14H26N2O/c1-16(2)14(17)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15H,3-10H2,1-2H3
InChIKeyWTGYMWQYWLUJDW-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds3

About 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide

2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide (PubChem CID 43224493) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide
PubChem CID43224493
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCC2CCCCC2C1
InChIInChI=1S/C14H26N2O/c1-16(2)14(17)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15H,3-10H2,1-2H3
InChIKeyWTGYMWQYWLUJDW-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide?
The IUPAC name of 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide (CID 43224493) is 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide is CN(C)C(=O)CNC1CCC2CCCCC2C1.
What is the InChIKey of 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide?
The InChIKey is WTGYMWQYWLUJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-16(2)14(17)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide?
2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide has a molecular weight of 238.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide is sourced from PubChem (CID 43224493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).