N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide

C17H28N2O2 — CID 2858736

IUPACN-(1-adamantylmethyl)-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)NCC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H28N2O2/c20-16(11-19-1-3-21-4-2-19)18-12-17-8-13-5-14(9-17)7-15(6-13)10-17/h13-15H,1-12H2,(H,18,20)
InChIKeyHNGXFCPCZVNAQA-UHFFFAOYSA-N
MW292.42 g/mol
LogP1.65
Rot. Bonds4

About N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide

N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide (PubChem CID 2858736) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(1-adamantylmethyl)-2-morpholin-4-ylacetamide
PubChem CID2858736
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-(1-adamantylmethyl)-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)NCC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H28N2O2/c20-16(11-19-1-3-21-4-2-19)18-12-17-8-13-5-14(9-17)7-15(6-13)10-17/h13-15H,1-12H2,(H,18,20)
InChIKeyHNGXFCPCZVNAQA-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylpiperazin-1-yl)-N-[[(3R,6R)-1-tricyclo[4.3.1.13,8]undecanyl]methyl]acetamide
CID 22489803
N-(1-adamantylmethyl)-2-(4-benzylpiperazin-1-yl)acetamide
CID 8902332
N-(1-adamantylmethyl)-4-(morpholin-4-ylmethyl)benzamide
CID 9047114
N-[(1-hydroxycyclopentyl)methyl]-2-morpholin-4-ylacetamide
CID 110011664
N-(1-adamantylmethyl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
CID 8932536
2-[2-(1-adamantylmethylamino)-2-oxoethyl]pyrazole-3-carboxylic acid
CID 19485553
2-morpholin-4-yl-1-(1-tricyclo[4.3.1.13,8]undecanyl)ethanone
CID 2874634
N-(1-adamantylmethyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 8583065
2-(3-hydroxy-1-adamantyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]acetamide
CID 24620546
N-(2-adamantyl)-2-morpholin-4-ylacetamide;hydrochloride
CID 2941980
N-(1-adamantylmethyl)-3-(2-morpholin-4-ylethyl)-2-oxobenzimidazole-1-carboxamide
CID 66783944
N-(2-morpholin-4-ylethyl)adamantane-1-carboxamide
CID 2862149

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide (CID 2858736) is N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide is O=C(CN1CCOCC1)NCC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide?
The InChIKey is HNGXFCPCZVNAQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c20-16(11-19-1-3-21-4-2-19)18-12-17-8-13-5-14(9-17)7-15(6-13)10-17/h13-15H,1-12H2,(H,18,20).
What are the key properties of N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide?
N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide has a molecular weight of 292.42 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantylmethyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 2858736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).