N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide

C14H25NO2 — CID 111463205

IUPACN-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(CC(=O)NCC2(O)CCC2)C1
InChIInChI=1S/C14H25NO2/c1-11-4-2-5-12(8-11)9-13(16)15-10-14(17)6-3-7-14/h11-12,17H,2-10H2,1H3,(H,15,16)
InChIKeyQFHOPSWVQINOMX-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.23
Rot. Bonds4

About N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide

N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide (PubChem CID 111463205) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide
PubChem CID111463205
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(CC(=O)NCC2(O)CCC2)C1
InChIInChI=1S/C14H25NO2/c1-11-4-2-5-12(8-11)9-13(16)15-10-14(17)6-3-7-14/h11-12,17H,2-10H2,1H3,(H,15,16)
InChIKeyQFHOPSWVQINOMX-UHFFFAOYSA-N
XLogP2.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-hydroxycycloheptyl)methyl]-2-[(1S,3S)-3-methylcyclohexyl]acetamide
CID 99809445
2-cyclobutyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]acetamide
CID 103164693
2-[(1S,3R)-3-methylcyclohexyl]-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]acetamide
CID 99793014
N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide
CID 119507538
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[(1-hydroxycyclohexyl)methyl]acetamide
CID 79615256
2-cycloheptyl-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
CID 111825728
2-cyclobutyl-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 103849320
2-cyclobutyl-N-[(3-hydroxypyrrolidin-3-yl)methyl]acetamide
CID 103162273
1-[(3R)-3-methylcyclohexyl]propan-2-one
CID 130348727
4-cyclohexyl-N-[(1-hydroxycyclobutyl)methyl]butanamide
CID 115643503
2-(cyclopropylmethylamino)-N-[(1-hydroxy-4-methylcyclohexyl)methyl]acetamide
CID 65119831
2-cycloheptyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]acetamide
CID 107301867

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide?
The IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide (CID 111463205) is N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide.
What is the SMILES notation for N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide?
The canonical SMILES for N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide is CC1CCCC(CC(=O)NCC2(O)CCC2)C1.
What is the InChIKey of N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide?
The InChIKey is QFHOPSWVQINOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-11-4-2-5-12(8-11)9-13(16)15-10-14(17)6-3-7-14/h11-12,17H,2-10H2,1H3,(H,15,16).
What are the key properties of N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide?
N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide has a molecular weight of 239.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclobutyl)methyl]-2-(3-methylcyclohexyl)acetamide is sourced from PubChem (CID 111463205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).