2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide

C14H28N2O2 — CID 65118585

IUPAC2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide
SMILESCCC1CCC(O)(CNC(C)C(=O)N(C)C)CC1
InChIInChI=1S/C14H28N2O2/c1-5-12-6-8-14(18,9-7-12)10-15-11(2)13(17)16(3)4/h11-12,15,18H,5-10H2,1-4H3
InChIKeyFRQQWTRESGYHHG-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.38
Rot. Bonds5

About 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide

2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide (PubChem CID 65118585) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide
PubChem CID65118585
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide
SMILESCCC1CCC(O)(CNC(C)C(=O)N(C)C)CC1
InChIInChI=1S/C14H28N2O2/c1-5-12-6-8-14(18,9-7-12)10-15-11(2)13(17)16(3)4/h11-12,15,18H,5-10H2,1-4H3
InChIKeyFRQQWTRESGYHHG-UHFFFAOYSA-N
XLogP1.38
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N-methylpropanamide
CID 65118871
2-[(1-hydroxycycloheptyl)methylamino]-N,N-dimethylpropanamide
CID 54950879
methyl 3-[(4-ethyl-1-hydroxycyclohexyl)methylamino]butanoate
CID 65118877
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 65124264
2-[(3-hydroxyoxolan-3-yl)methylamino]-N,N-dimethylpropanamide
CID 106100495
4-[[[1-(diethylamino)-1-oxopropan-2-yl]amino]methyl]-4-hydroxycyclohexane-1-carboxylic acid
CID 106499719
N-ethyl-2-[(1-hydroxycyclopentyl)methylamino]-N-methylpropanamide
CID 103108861
2-[(4-ethylcyclohexyl)amino]-N,N-dimethylpropanamide
CID 43573917
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-3-(propan-2-ylamino)propanamide
CID 65119958
methyl 2-cyclopropyl-2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]acetate
CID 103253418
2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-N,N-dimethylpropanamide
CID 115359532
2-[(1-hydroxy-4-methylcyclohexyl)methylamino]propanoic acid
CID 65116400

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide (CID 65118585) is 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide is CCC1CCC(O)(CNC(C)C(=O)N(C)C)CC1.
What is the InChIKey of 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide?
The InChIKey is FRQQWTRESGYHHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-12-6-8-14(18,9-7-12)10-15-11(2)13(17)16(3)4/h11-12,15,18H,5-10H2,1-4H3.
What are the key properties of 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide?
2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 1.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 65118585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).