[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine

C10H19NO — CID 165482670

IUPAC[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine
SMILESCC(C)OC1(CN)CC[C@@H]2C[C@@H]21
InChIInChI=1S/C10H19NO/c1-7(2)12-10(6-11)4-3-8-5-9(8)10/h7-9H,3-6,11H2,1-2H3/t8-,9+,10?/m1/s1
InChIKeyKCKKQSVDXJIERM-ZDGBYWQASA-N
MW169.27 g/mol
LogP1.54
Rot. Bonds3

About [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine

[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine (PubChem CID 165482670) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine.

Molecular Properties

Compound Name[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine
PubChem CID165482670
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine
SMILESCC(C)OC1(CN)CC[C@@H]2C[C@@H]21
InChIInChI=1S/C10H19NO/c1-7(2)12-10(6-11)4-3-8-5-9(8)10/h7-9H,3-6,11H2,1-2H3/t8-,9+,10?/m1/s1
InChIKeyKCKKQSVDXJIERM-ZDGBYWQASA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine with MolForge

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Related Compounds

(2-fluoro-2-bicyclo[3.1.0]hexanyl)methanamine
CID 171036623
2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine
CID 130525697
2-[2-(1-aminoethyl)-2-bicyclo[3.1.0]hexanyl]acetic acid
CID 130526334
[(1R,4aR,4bR,7S,8aR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]methanamine
CID 92969815
propan-2-yl N-[1-(aminomethyl)-4-methylcyclohexyl]carbamate
CID 63765786
[(1R,6R)-7-methoxy-7-bicyclo[4.2.0]octanyl]methanamine
CID 178199643
3-[1-(aminomethyl)-2-ethylcyclohexyl]oxybutan-2-ol
CID 103377191
[1-(aminomethyl)-4-propan-2-ylcyclohexyl]-(3-methylcyclohexyl)methanol
CID 79125813
[1-(3,5-dimethylcyclohexyl)oxy-4-propan-2-ylcyclohexyl]methanamine
CID 64731650
1-(aminomethyl)-N-(2-methylpropyl)-4-propan-2-ylcyclohexan-1-amine
CID 65385412
2-[1-(aminomethyl)-2-methylcyclobutyl]oxyethanol
CID 130555490
[10-(aminomethyl)-4,10-dimethyl-4-tricyclo[6.3.1.02,7]dodecanyl]methanamine
CID 166919292

Frequently Asked Questions

What is the IUPAC name of [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine?
The IUPAC name of [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine (CID 165482670) is [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine.
What is the SMILES notation for [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine?
The canonical SMILES for [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine is CC(C)OC1(CN)CC[C@@H]2C[C@@H]21.
What is the InChIKey of [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine?
The InChIKey is KCKKQSVDXJIERM-ZDGBYWQASA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)12-10(6-11)4-3-8-5-9(8)10/h7-9H,3-6,11H2,1-2H3/t8-,9+,10?/m1/s1.
What are the key properties of [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine?
[(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine has a molecular weight of 169.27 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,5R)-2-propan-2-yloxy-2-bicyclo[3.1.0]hexanyl]methanamine is sourced from PubChem (CID 165482670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).