2-(2-adamantylamino)-N-(2-methylpropyl)acetamide

C16H28N2O — CID 115574907

IUPAC2-(2-adamantylamino)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CNC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H28N2O/c1-10(2)8-17-15(19)9-18-16-13-4-11-3-12(6-13)7-14(16)5-11/h10-14,16,18H,3-9H2,1-2H3,(H,17,19)
InChIKeyFILRAHHNSPYGBY-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.17
Rot. Bonds5

About 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide

2-(2-adamantylamino)-N-(2-methylpropyl)acetamide (PubChem CID 115574907) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-adamantylamino)-N-(2-methylpropyl)acetamide
PubChem CID115574907
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-(2-adamantylamino)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CNC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H28N2O/c1-10(2)8-17-15(19)9-18-16-13-4-11-3-12(6-13)7-14(16)5-11/h10-14,16,18H,3-9H2,1-2H3,(H,17,19)
InChIKeyFILRAHHNSPYGBY-UHFFFAOYSA-N
XLogP2.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-adamantylamino)acetic acid;hydrochloride
CID 163342547
N-(2-adamantyl)-3-methylbutanamide
CID 959856
N-(2-methylpropyl)-2-(oxan-3-ylamino)acetamide
CID 63363449
4-[[2-(2-methylpropylamino)-2-oxoethyl]amino]cyclohexane-1-carboxylic acid
CID 60809879
2-[(1-acetylpiperidin-4-yl)amino]-N-(2-methylpropyl)acetamide
CID 113219515
N-(2-methylpropyl)-2-(thiolan-3-ylamino)acetamide
CID 115920118
3-(2-adamantylamino)-N-ethylpropanamide
CID 113409667
[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]methyl N-(2-methylpropyl)carbamate
CID 24948739
N-(2-methylpropyl)-2-[(2,2,5,5-tetramethyloxolan-3-yl)amino]acetamide
CID 112568427
2-[(4-hydroxycyclohexyl)methylamino]-N-(2-methylpropyl)acetamide
CID 106133696
N-(2-adamantylmethyl)-2-(methylamino)acetamide
CID 120705568
[2-(2-methylpropylcarbamoylamino)-2-oxoethyl] adamantane-2-carboxylate
CID 8519506

Frequently Asked Questions

What is the IUPAC name of 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide (CID 115574907) is 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)CNC1C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide?
The InChIKey is FILRAHHNSPYGBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-10(2)8-17-15(19)9-18-16-13-4-11-3-12(6-13)7-14(16)5-11/h10-14,16,18H,3-9H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide?
2-(2-adamantylamino)-N-(2-methylpropyl)acetamide has a molecular weight of 264.41 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-adamantylamino)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 115574907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).