N-(2-adamantyl)-2-(diethylamino)acetamide

C16H28N2O — CID 7471172

IUPACN-(2-adamantyl)-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H28N2O/c1-3-18(4-2)10-15(19)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyHBPAOAJFTFHHST-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.27
Rot. Bonds5

About N-(2-adamantyl)-2-(diethylamino)acetamide

N-(2-adamantyl)-2-(diethylamino)acetamide (PubChem CID 7471172) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-(2-adamantyl)-2-(diethylamino)acetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-(diethylamino)acetamide
PubChem CID7471172
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-(2-adamantyl)-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H28N2O/c1-3-18(4-2)10-15(19)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,3-10H2,1-2H3,(H,17,19)
InChIKeyHBPAOAJFTFHHST-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

PF-877423
CID 11601544
(2R)-N-(adamantan-2-yl)-1-propylpyrrolidine-2-carboxamide
CID 11565519
(2R)-N-(adamantan-2-yl)-1-(cyclopentylmethyl)pyrrolidine-2-carboxamide
CID 11667087
(2R)-N-(adamantan-2-yl)-1-(cyclohexylmethyl)pyrrolidine-2-carboxamide
CID 11695884
Acetamide, N-1-adamantyl-2-(diethylamino)-, monohydrochloride
CID 64201
(2R)-N-(adamantan-2-yl)-1-(2-methylpropyl)pyrrolidine-2-carboxamide
CID 46888801
(2R)-N-(adamantan-2-yl)-1-(cyclobutylmethyl)pyrrolidine-2-carboxamide
CID 46888802
N-(2-adamantyl)butanamide
CID 894015
N-(adamantan-2-yl)-2-[cyclohexyl(ethyl)amino]acetamide
CID 11638307
CID 44327160
CID 44327160
(2S,4S)-1-[2-(2-adamantylamino)acetyl]-4-fluoropyrrolidine-2-carbonitrile
CID 44560185
(2R)-N-(adamantan-2-yl)-1-(propan-2-yl)pyrrolidine-2-carboxamide
CID 46888800

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-(diethylamino)acetamide?
The IUPAC name of N-(2-adamantyl)-2-(diethylamino)acetamide (CID 7471172) is N-(2-adamantyl)-2-(diethylamino)acetamide.
What is the SMILES notation for N-(2-adamantyl)-2-(diethylamino)acetamide?
The canonical SMILES for N-(2-adamantyl)-2-(diethylamino)acetamide is CCN(CC)CC(=O)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-(diethylamino)acetamide?
The InChIKey is HBPAOAJFTFHHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-3-18(4-2)10-15(19)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,3-10H2,1-2H3,(H,17,19).
What are the key properties of N-(2-adamantyl)-2-(diethylamino)acetamide?
N-(2-adamantyl)-2-(diethylamino)acetamide has a molecular weight of 264.41 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-(diethylamino)acetamide is sourced from PubChem (CID 7471172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).