(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine

C8H16N2 — CID 21188422

IUPAC(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine
SMILESCN1C2CCC1C(CN)C2
InChIInChI=1S/C8H16N2/c1-10-7-2-3-8(10)6(4-7)5-9/h6-8H,2-5,9H2,1H3
InChIKeyHSXGDXMSSVOIKV-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.43
Rot. Bonds1

About (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine

(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine (PubChem CID 21188422) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine.

Molecular Properties

Compound Name(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine
PubChem CID21188422
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine
SMILESCN1C2CCC1C(CN)C2
InChIInChI=1S/C8H16N2/c1-10-7-2-3-8(10)6(4-7)5-9/h6-8H,2-5,9H2,1H3
InChIKeyHSXGDXMSSVOIKV-UHFFFAOYSA-N
XLogP0.43
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 ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine?
The IUPAC name of (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine (CID 21188422) is (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine.
What is the SMILES notation for (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine?
The canonical SMILES for (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine is CN1C2CCC1C(CN)C2.
What is the InChIKey of (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine?
The InChIKey is HSXGDXMSSVOIKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-7-2-3-8(10)6(4-7)5-9/h6-8H,2-5,9H2,1H3.
What are the key properties of (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine?
(7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine has a molecular weight of 140.23 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-7-azabicyclo[2.2.1]heptan-2-yl)methanamine is sourced from PubChem (CID 21188422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).