2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide

C11H21N3O — CID 51891967

IUPAC2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide
SMILESCN1[C@@H]2CC[C@H]1CC(CNC(=O)CN)C2
InChIInChI=1S/C11H21N3O/c1-14-9-2-3-10(14)5-8(4-9)7-13-11(15)6-12/h8-10H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10+
InChIKeyUQAPMMIRQVUUDN-PBINXNQUSA-N
MW211.31 g/mol
LogP-0.07
Rot. Bonds3

About 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide

2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide (PubChem CID 51891967) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide
PubChem CID51891967
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide
SMILESCN1[C@@H]2CC[C@H]1CC(CNC(=O)CN)C2
InChIInChI=1S/C11H21N3O/c1-14-9-2-3-10(14)5-8(4-9)7-13-11(15)6-12/h8-10H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10+
InChIKeyUQAPMMIRQVUUDN-PBINXNQUSA-N
XLogP-0.07
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide with MolForge

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Related Compounds

2-(cyclopropylamino)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]acetamide
CID 54898471
(2S)-2-amino-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propanamide
CID 61149354
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605227
2-amino-N-[(3-hydroxycyclobutyl)methyl]acetamide
CID 66005079
(2S)-2-amino-3-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pentanamide
CID 61173579
1-cyclopropyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine
CID 61013267
methyl 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]propanoate
CID 66173751
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 54898994
2-amino-N-[(1-propylpiperidin-4-yl)methyl]acetamide;dihydrochloride
CID 119861461
2-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]piperidine-2-carboxamide
CID 104596521
4-bromo-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]benzamide
CID 61019144
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]piperidine-2-carboxamide
CID 54898996

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide?
The IUPAC name of 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide (CID 51891967) is 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide.
What is the SMILES notation for 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide?
The canonical SMILES for 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide is CN1[C@@H]2CC[C@H]1CC(CNC(=O)CN)C2.
What is the InChIKey of 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide?
The InChIKey is UQAPMMIRQVUUDN-PBINXNQUSA-N. The full InChI is InChI=1S/C11H21N3O/c1-14-9-2-3-10(14)5-8(4-9)7-13-11(15)6-12/h8-10H,2-7,12H2,1H3,(H,13,15)/t8?,9-,10+.
What are the key properties of 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide?
2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide has a molecular weight of 211.31 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]acetamide is sourced from PubChem (CID 51891967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).