N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide

C16H23FN2O — CID 63243623

IUPACN-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide
SMILESCC1CCC(CNCC(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C16H23FN2O/c1-12-2-4-13(5-3-12)10-18-11-16(20)19-15-8-6-14(17)7-9-15/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,19,20)
InChIKeyQJVZNJBKMMZMLY-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.18
Rot. Bonds5

About N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide

N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide (PubChem CID 63243623) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide
PubChem CID63243623
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC NameN-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide
SMILESCC1CCC(CNCC(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C16H23FN2O/c1-12-2-4-13(5-3-12)10-18-11-16(20)19-15-8-6-14(17)7-9-15/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,19,20)
InChIKeyQJVZNJBKMMZMLY-UHFFFAOYSA-N
XLogP3.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
CID 119758034
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
methyl N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]carbamate
CID 60866405
2-(cyclopropylmethylamino)-N-(4-methylsulfanylphenyl)acetamide;hydrochloride
CID 119694268
2-[(1-ethylpyrrolidin-3-yl)methylamino]-N-(4-fluorophenyl)acetamide
CID 60856879
2-(cyclopropylmethylamino)-N-(4-fluoro-3-methylphenyl)acetamide;hydrochloride
CID 119707226
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
N-(4-fluorophenyl)-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]acetamide
CID 2697800
N-(4-fluorophenyl)-2-(propylamino)acetamide
CID 28586343
4-[[2-(cyclopropylmethylamino)acetyl]amino]-N-methylbenzamide
CID 60868348
2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]cyclopropanecarboxamide;hydrochloride
CID 119700150

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide (CID 63243623) is N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide is CC1CCC(CNCC(=O)Nc2ccc(F)cc2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide?
The InChIKey is QJVZNJBKMMZMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-12-2-4-13(5-3-12)10-18-11-16(20)19-15-8-6-14(17)7-9-15/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,19,20).
What are the key properties of N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide?
N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide has a molecular weight of 278.37 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide is sourced from PubChem (CID 63243623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).