N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide

C11H20N2O — CID 123830915

IUPACN-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide
SMILESC=C1CCCCC1NCCNC(C)=O
InChIInChI=1S/C11H20N2O/c1-9-5-3-4-6-11(9)13-8-7-12-10(2)14/h11,13H,1,3-8H2,2H3,(H,12,14)
InChIKeyXAJNICAMXKAJPN-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.21
Rot. Bonds4

About N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide

N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide (PubChem CID 123830915) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide
PubChem CID123830915
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide
SMILESC=C1CCCCC1NCCNC(C)=O
InChIInChI=1S/C11H20N2O/c1-9-5-3-4-6-11(9)13-8-7-12-10(2)14/h11,13H,1,3-8H2,2H3,(H,12,14)
InChIKeyXAJNICAMXKAJPN-UHFFFAOYSA-N
XLogP1.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-fluoro-5-methylidenecyclohexyl)acetamide
CID 90885330
N-((1-(2-Cyclohexylideneethyl)-2-pyrrolidinyl)methyl)acetamide
CID 3024074
N-(6-methylhept-6-en-2-yl)acetamide
CID 19865089
4-(4-Methylidenecyclohexyl)piperazin-2-one
CID 58902675
N,N-dimethyl-2-[(4-methylidenecyclohexyl)amino]acetamide
CID 58902682
N-(4-methylidenecyclohexyl)acetamide
CID 58902716
N-(4-methylidenecyclohexyl)propanamide
CID 58902762
2-[(4-Methylidenecyclohexyl)amino]acetamide
CID 58902781
(2S)-2-amino-4-methyl-N-prop-2-enylpent-4-enamide
CID 59280332
N-(3-methylidenehexyl)acetamide
CID 59355406
2-amino-4-methyl-N-prop-2-enylpent-4-enamide
CID 72245159
2-amino-N-(2,5-dimethylhex-1-en-3-yl)acetamide
CID 88288970

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide?
The IUPAC name of N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide (CID 123830915) is N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide.
What is the SMILES notation for N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide?
The canonical SMILES for N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide is C=C1CCCCC1NCCNC(C)=O.
What is the InChIKey of N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide?
The InChIKey is XAJNICAMXKAJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9-5-3-4-6-11(9)13-8-7-12-10(2)14/h11,13H,1,3-8H2,2H3,(H,12,14).
What are the key properties of N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide?
N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide has a molecular weight of 196.29 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methylidenecyclohexyl)amino]ethyl]acetamide is sourced from PubChem (CID 123830915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).