2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide

C12H22N2O — CID 107908317

IUPAC2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC1C=CCCC1
InChIInChI=1S/C12H22N2O/c1-4-14(3)12(15)10(2)13-11-8-6-5-7-9-11/h6,8,10-11,13H,4-5,7,9H2,1-3H3
InChIKeySGSCLTKWYFMQTC-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.55
Rot. Bonds4

About 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide

2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide (PubChem CID 107908317) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide
PubChem CID107908317
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC1C=CCCC1
InChIInChI=1S/C12H22N2O/c1-4-14(3)12(15)10(2)13-11-8-6-5-7-9-11/h6,8,10-11,13H,4-5,7,9H2,1-3H3
InChIKeySGSCLTKWYFMQTC-UHFFFAOYSA-N
XLogP1.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclobutylamino)-N-ethyl-N-methylpropanamide
CID 103108088
N-(4-methylpent-1-yn-3-yl)cyclohex-2-en-1-amine
CID 130481453
N-ethyl-N-methyl-2-(oxan-4-ylamino)propanamide
CID 103107263
2-(cyclohex-2-en-1-ylamino)-3-methylbutanamide
CID 103914307
N-ethyl-2-[(4-hydroxyoxolan-3-yl)amino]-N-methylpropanamide
CID 103108571
N-ethyl-N-methyl-2-(propan-2-ylamino)propanamide
CID 103107904
N-ethyl-2-[(3-ethylcyclopentyl)amino]-N-methylpropanamide
CID 103107637
2-[(4-tert-butylcyclohexyl)amino]-N-ethyl-N-methylpropanamide
CID 103107530
N-(1-cyclobutylethyl)cyclohex-2-en-1-amine
CID 103903529
ethyl (2S)-2-[[(1R)-cyclohex-2-en-1-yl]amino]-2-(oxan-4-yl)acetate
CID 124885895
N-ethyl-N-methyl-2-[(2-piperidin-2-ylcyclohexyl)amino]propanamide
CID 103107021
2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide (CID 107908317) is 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)NC1C=CCCC1.
What is the InChIKey of 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide?
The InChIKey is SGSCLTKWYFMQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-4-14(3)12(15)10(2)13-11-8-6-5-7-9-11/h6,8,10-11,13H,4-5,7,9H2,1-3H3.
What are the key properties of 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide?
2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide has a molecular weight of 210.32 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohex-2-en-1-ylamino)-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 107908317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).