N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide

C14H26N2O — CID 123351392

IUPACN-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide
SMILESC=C1CCC(N(CCCN(C)C)C(C)=O)CC1
InChIInChI=1S/C14H26N2O/c1-12-6-8-14(9-7-12)16(13(2)17)11-5-10-15(3)4/h14H,1,5-11H2,2-4H3
InChIKeyUKPLIYXZDHYBJU-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.29
Rot. Bonds5

About N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide

N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide (PubChem CID 123351392) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide
PubChem CID123351392
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide
SMILESC=C1CCC(N(CCCN(C)C)C(C)=O)CC1
InChIInChI=1S/C14H26N2O/c1-12-6-8-14(9-7-12)16(13(2)17)11-5-10-15(3)4/h14H,1,5-11H2,2-4H3
InChIKeyUKPLIYXZDHYBJU-UHFFFAOYSA-N
XLogP2.29
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(2R)-5-ethyl-2-methyl-3,4-dihydro-2H-pyridin-1-yl]ethanone
CID 53955610
1-[4-(4-Methylidenecyclohexyl)piperazin-1-yl]ethanone
CID 58902777
N-cyclohexyl-N-methyl-4-methylideneheptanamide
CID 70253368
N-cyclohexyl-N-(3-methylbut-3-enyl)prop-2-enamide
CID 90889365
N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)propanamide
CID 90912916
N-methyl-N-(3-methylidenecyclohexyl)acetamide
CID 90986487
1-(2-Prop-1-en-2-ylpiperidin-1-yl)ethanone
CID 91499746
1-(2-Ethyl-4-methylidenepiperidin-1-yl)ethanone
CID 121367272
Ethane;1-(4-methylidenecyclohexyl)pyrrolidin-2-one
CID 123551438
2-(dimethylamino)-N-methyl-N-(4-methylidenecyclohexyl)acetamide
CID 123966148
1-(2-Methyl-4-methylidenepiperidin-1-yl)ethanone
CID 134165353
N-[2-(aminomethyl)prop-2-enyl]-N-cyclohexylacetamide
CID 166689267

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide (CID 123351392) is N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide is C=C1CCC(N(CCCN(C)C)C(C)=O)CC1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide?
The InChIKey is UKPLIYXZDHYBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12-6-8-14(9-7-12)16(13(2)17)11-5-10-15(3)4/h14H,1,5-11H2,2-4H3.
What are the key properties of N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide?
N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide has a molecular weight of 238.37 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-(4-methylidenecyclohexyl)acetamide is sourced from PubChem (CID 123351392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).