2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide

C16H30N2O2 — CID 102848635

IUPAC2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CN(CCCO)C1CCC1)C1CCCCC1
InChIInChI=1S/C16H30N2O2/c1-17(14-7-3-2-4-8-14)16(20)13-18(11-6-12-19)15-9-5-10-15/h14-15,19H,2-13H2,1H3
InChIKeyHFXWAHWCSQZRON-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.01
Rot. Bonds7

About 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide

2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide (PubChem CID 102848635) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide.

Molecular Properties

Compound Name2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide
PubChem CID102848635
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CN(CCCO)C1CCC1)C1CCCCC1
InChIInChI=1S/C16H30N2O2/c1-17(14-7-3-2-4-8-14)16(20)13-18(11-6-12-19)15-9-5-10-15/h14-15,19H,2-13H2,1H3
InChIKeyHFXWAHWCSQZRON-UHFFFAOYSA-N
XLogP2.01
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
CID 102676811
N-cyclohexyl-2-[cyclopropyl(2-hydroxyethyl)amino]-N-methylacetamide
CID 60774513
2-[cyclopentyl-[2-[cyclopropyl(methyl)amino]-2-oxoethyl]amino]acetic acid
CID 54957297
N-cycloheptyl-2-hydroxy-N-methylacetamide
CID 130678772
methyl 2-[cyclopentyl-[2-[cyclopropyl(methyl)amino]-2-oxoethyl]amino]acetate
CID 80710059
3-[cycloheptyl(3-hydroxypropyl)amino]propanoic acid
CID 82330129
methyl 2-[cyclopentyl(6-hydroxyhexyl)amino]acetate
CID 103768668
3-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-(2-hydroxyethyl)amino]propanoic acid
CID 82327378
2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide
CID 62015445
N-cyclohexyl-2-[2-hydroxyethyl(2-methoxyethyl)amino]-N-methylacetamide
CID 115613753
2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-dipropylacetamide
CID 62015247
2-[5-hydroxypentyl(methyl)amino]-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 107203823

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide?
The IUPAC name of 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide (CID 102848635) is 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide.
What is the SMILES notation for 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide?
The canonical SMILES for 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide is CN(C(=O)CN(CCCO)C1CCC1)C1CCCCC1.
What is the InChIKey of 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide?
The InChIKey is HFXWAHWCSQZRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-17(14-7-3-2-4-8-14)16(20)13-18(11-6-12-19)15-9-5-10-15/h14-15,19H,2-13H2,1H3.
What are the key properties of 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide?
2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide has a molecular weight of 282.43 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(3-hydroxypropyl)amino]-N-cyclohexyl-N-methylacetamide is sourced from PubChem (CID 102848635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).