N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide

C15H30N2O2 — CID 111538536

IUPACN-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide
SMILESCCCCN(C)CCNC(=O)CC1(O)CCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-4-11-17(2)12-10-16-14(18)13-15(19)8-6-5-7-9-15/h19H,3-13H2,1-2H3,(H,16,18)
InChIKeyKKDLUQGTQHTFCN-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.92
Rot. Bonds8

About N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide

N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide (PubChem CID 111538536) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound NameN-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide
PubChem CID111538536
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide
SMILESCCCCN(C)CCNC(=O)CC1(O)CCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-4-11-17(2)12-10-16-14(18)13-15(19)8-6-5-7-9-15/h19H,3-13H2,1-2H3,(H,16,18)
InChIKeyKKDLUQGTQHTFCN-UHFFFAOYSA-N
XLogP1.92
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-hydroxycyclohexyl)-N-[2-[methyl(propan-2-yl)amino]ethyl]acetamide
CID 111464650
N-(2-butoxyethyl)-2-(1-hydroxycyclohexyl)acetamide
CID 111537332
1-[2-[2-[ethyl(methyl)amino]ethylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 62642132
1-[2-[2-[ethyl(methyl)amino]ethylamino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 62641943
2-[1-(aminomethyl)cyclohexyl]-N-[2-[ethyl(methyl)amino]ethyl]acetamide
CID 113440176
3-[butyl(methyl)amino]-N-propylpropanamide
CID 108795247
N-[2-[[2-(1-hydroxycyclopentyl)acetyl]amino]ethyl]-2-methylpropanamide
CID 111430885
N-[(1-ethylcyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111969896
N-[(1-hydroxycyclobutyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111539371
3-[butyl(methyl)amino]-N-pentadecylpropanamide
CID 58040616
1-[2-(butylamino)-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 43529487
N-hexyl-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242387

Frequently Asked Questions

What is the IUPAC name of N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide?
The IUPAC name of N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide (CID 111538536) is N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide.
What is the SMILES notation for N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide?
The canonical SMILES for N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide is CCCCN(C)CCNC(=O)CC1(O)CCCCC1.
What is the InChIKey of N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide?
The InChIKey is KKDLUQGTQHTFCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-4-11-17(2)12-10-16-14(18)13-15(19)8-6-5-7-9-15/h19H,3-13H2,1-2H3,(H,16,18).
What are the key properties of N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide?
N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide has a molecular weight of 270.42 g/mol, XLogP of 1.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butyl(methyl)amino]ethyl]-2-(1-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 111538536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).