[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine

C8H16N2 — CID 92547246

IUPAC[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine
SMILESCN1CC[C@@H]2[C@@H](CN)[C@@H]2C1
InChIInChI=1S/C8H16N2/c1-10-3-2-6-7(4-9)8(6)5-10/h6-8H,2-5,9H2,1H3/t6-,7-,8-/m1/s1
InChIKeyDLPAPNDGYQEZDM-BWZBUEFSSA-N
MW140.23 g/mol
LogP0.14
Rot. Bonds1

About [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine

[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine (PubChem CID 92547246) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine.

Molecular Properties

Compound Name[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine
PubChem CID92547246
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine
SMILESCN1CC[C@@H]2[C@@H](CN)[C@@H]2C1
InChIInChI=1S/C8H16N2/c1-10-3-2-6-7(4-9)8(6)5-10/h6-8H,2-5,9H2,1H3/t6-,7-,8-/m1/s1
InChIKeyDLPAPNDGYQEZDM-BWZBUEFSSA-N
XLogP0.14
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(1-methylpiperidin-4-yl)methanamine
CID 91043349
(1,3-dimethylpiperidin-4-yl)methanamine
CID 55285263
(1-methyl-3-propylpiperidin-4-yl)methanamine
CID 84765836
(3-cyclopentyl-3-azabicyclo[3.1.0]hexan-6-yl)methanamine
CID 83828286
[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]methanamine
CID 43373551
N'-methyl-N'-(1-methylpyrrolidin-3-yl)methanediamine
CID 115225658
(4-methyl-1-phosphanylpiperazin-2-yl)methanamine
CID 142243069
[1-[2-(1-methylpiperidin-4-yl)ethyl]pyrrolidin-3-yl]methanamine
CID 114515912
(1-methylpyrrolidin-3-yl)methanesulfinamide
CID 154660434
(1,2-dimethyldiazinan-4-yl)methanamine
CID 84648894
(1,5-dimethylazepan-4-yl)methanamine
CID 84763759
(4R)-1-methylpiperidine-3,4-diamine
CID 145189555

Frequently Asked Questions

What is the IUPAC name of [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine?
The IUPAC name of [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine (CID 92547246) is [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine.
What is the SMILES notation for [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine?
The canonical SMILES for [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine is CN1CC[C@@H]2[C@@H](CN)[C@@H]2C1.
What is the InChIKey of [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine?
The InChIKey is DLPAPNDGYQEZDM-BWZBUEFSSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-3-2-6-7(4-9)8(6)5-10/h6-8H,2-5,9H2,1H3/t6-,7-,8-/m1/s1.
What are the key properties of [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine?
[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine has a molecular weight of 140.23 g/mol, XLogP of 0.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine is sourced from PubChem (CID 92547246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).