2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide

C19H24FN3O2 — CID 7666448

IUPAC2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide
SMILESO=C(CNC12CC3CC(CC(C3)C1)C2)NC(=O)Nc1ccccc1F
InChIInChI=1S/C19H24FN3O2/c20-15-3-1-2-4-16(15)22-18(25)23-17(24)11-21-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14,21H,5-11H2,(H2,22,23,24,25)
InChIKeyMLIXZVMUCQXCGJ-UHFFFAOYSA-N
MW345.42 g/mol
LogP3.03
Rot. Bonds4

About 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide

2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide (PubChem CID 7666448) has the molecular formula C19H24FN3O2 and a molecular weight of 345.42 g/mol. Its IUPAC name is 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide.

Molecular Properties

Compound Name2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide
PubChem CID7666448
Molecular FormulaC19H24FN3O2
Molecular Weight345.42 g/mol
Exact Mass345.19
IUPAC Name2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide
SMILESO=C(CNC12CC3CC(CC(C3)C1)C2)NC(=O)Nc1ccccc1F
InChIInChI=1S/C19H24FN3O2/c20-15-3-1-2-4-16(15)22-18(25)23-17(24)11-21-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14,21H,5-11H2,(H2,22,23,24,25)
InChIKeyMLIXZVMUCQXCGJ-UHFFFAOYSA-N
XLogP3.03
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 53.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-adamantylamino)-N-(2,3-dimethylphenyl)acetamide
CID 7536722
[2-(2-fluoroanilino)-2-oxoethyl] adamantane-1-carboxylate
CID 5008790
2-(1-adamantylamino)-N-(9,10-dioxoanthracen-1-yl)acetamide
CID 9032292
2-(1-adamantylamino)-N-(4-chlorophenyl)acetamide
CID 9032255
2-(1-adamantylamino)-1-phenylethanone
CID 14291475
N-[(2-fluorophenyl)carbamoyl]-2-piperidin-1-ylacetamide
CID 8894654
5-[(2-fluorophenyl)carbamoylamino]-3-methyl-5-oxopentanoic acid
CID 62964130
N-(1-adamantylcarbamoyl)-2-(2-methoxyanilino)acetamide
CID 9345285
(2S)-2-(1-adamantylsulfanyl)-N-(2-fluorophenyl)propanamide
CID 8513195
1-(1-adamantyl)-3-[2-(trifluoromethyl)phenyl]urea
CID 108887719
N-(1-adamantylcarbamoyl)-2-(3,4-difluoroanilino)acetamide
CID 112799804
2-(1-adamantylamino)-N-(3-chlorophenyl)acetamide
CID 9032168

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide?
The IUPAC name of 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide (CID 7666448) is 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide.
What is the SMILES notation for 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide?
The canonical SMILES for 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide is O=C(CNC12CC3CC(CC(C3)C1)C2)NC(=O)Nc1ccccc1F.
What is the InChIKey of 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide?
The InChIKey is MLIXZVMUCQXCGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O2/c20-15-3-1-2-4-16(15)22-18(25)23-17(24)11-21-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14,21H,5-11H2,(H2,22,23,24,25).
What are the key properties of 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide?
2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide has a molecular weight of 345.42 g/mol, XLogP of 3.03, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantylamino)-N-[(2-fluorophenyl)carbamoyl]acetamide is sourced from PubChem (CID 7666448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).