N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide

C15H25NO — CID 164669950

IUPACN,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide
SMILESC=C1[C@@H](CC(=O)N(C)C)C(=C(C)C)CC[C@H]1C
InChIInChI=1S/C15H25NO/c1-10(2)13-8-7-11(3)12(4)14(13)9-15(17)16(5)6/h11,14H,4,7-9H2,1-3,5-6H3/t11-,14-/m1/s1
InChIKeyRXXSAZGXPUVKIJ-BXUZGUMPSA-N
MW235.37 g/mol
LogP3.40
Rot. Bonds2

About N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide

N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide (PubChem CID 164669950) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide
PubChem CID164669950
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide
SMILESC=C1[C@@H](CC(=O)N(C)C)C(=C(C)C)CC[C@H]1C
InChIInChI=1S/C15H25NO/c1-10(2)13-8-7-11(3)12(4)14(13)9-15(17)16(5)6/h11,14H,4,7-9H2,1-3,5-6H3/t11-,14-/m1/s1
InChIKeyRXXSAZGXPUVKIJ-BXUZGUMPSA-N
XLogP3.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide (CID 164669950) is N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide is C=C1[C@@H](CC(=O)N(C)C)C(=C(C)C)CC[C@H]1C.
What is the InChIKey of N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide?
The InChIKey is RXXSAZGXPUVKIJ-BXUZGUMPSA-N. The full InChI is InChI=1S/C15H25NO/c1-10(2)13-8-7-11(3)12(4)14(13)9-15(17)16(5)6/h11,14H,4,7-9H2,1-3,5-6H3/t11-,14-/m1/s1.
What are the key properties of N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide?
N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide has a molecular weight of 235.37 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(1R,3R)-3-methyl-2-methylidene-6-propan-2-ylidenecyclohexyl]acetamide is sourced from PubChem (CID 164669950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).