2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide

C18H35N3O — CID 119888440

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide
SMILESCN(C)CCC(NC(=O)CC1CC2CCC(C1)N2)C(C)(C)C
InChIInChI=1S/C18H35N3O/c1-18(2,3)16(8-9-21(4)5)20-17(22)12-13-10-14-6-7-15(11-13)19-14/h13-16,19H,6-12H2,1-5H3,(H,20,22)
InChIKeyUATXQJVUIAPESH-UHFFFAOYSA-N
MW309.50 g/mol
LogP2.39
Rot. Bonds6

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide (PubChem CID 119888440) has the molecular formula C18H35N3O and a molecular weight of 309.50 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide
PubChem CID119888440
Molecular FormulaC18H35N3O
Molecular Weight309.50 g/mol
Exact Mass309.28
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide
SMILESCN(C)CCC(NC(=O)CC1CC2CCC(C1)N2)C(C)(C)C
InChIInChI=1S/C18H35N3O/c1-18(2,3)16(8-9-21(4)5)20-17(22)12-13-10-14-6-7-15(11-13)19-14/h13-16,19H,6-12H2,1-5H3,(H,20,22)
InChIKeyUATXQJVUIAPESH-UHFFFAOYSA-N
XLogP2.39
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.50
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide with MolForge

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[4-(dimethylamino)butan-2-yl]acetamide
CID 79607442
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-methylhexan-2-yl)acetamide;hydrochloride
CID 119674904
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-butan-2-ylacetamide
CID 79608095
4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]pentanoic acid
CID 79615753
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2,2-dimethyl-1-phenylpropyl)acetamide;hydrochloride
CID 119724650
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(4-methoxybutan-2-yl)acetamide
CID 79615755
2-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-N-[(2S)-1-methylsulfanylpropan-2-yl]acetamide
CID 124592903
(2S)-2-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]hexanoic acid
CID 107146892
N-[4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]-3-(dimethylamino)propanamide;dihydrochloride
CID 119868270
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[3-(dimethylamino)propyl]-N-methylacetamide
CID 79615612
N-(1-amino-4,4-dimethylpentan-3-yl)-2-cyclopentylacetamide
CID 114178189
(2R)-2-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-3-hydroxypropanoic acid
CID 80750585

Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide (CID 119888440) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide is CN(C)CCC(NC(=O)CC1CC2CCC(C1)N2)C(C)(C)C.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide?
The InChIKey is UATXQJVUIAPESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O/c1-18(2,3)16(8-9-21(4)5)20-17(22)12-13-10-14-6-7-15(11-13)19-14/h13-16,19H,6-12H2,1-5H3,(H,20,22).
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide?
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide has a molecular weight of 309.50 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(dimethylamino)-4,4-dimethylpentan-3-yl]acetamide is sourced from PubChem (CID 119888440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).