1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine

C13H23N — CID 130494580

IUPAC1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1(C2CC3CCC2C3)CCC1
InChIInChI=1S/C13H23N/c1-14-9-13(5-2-6-13)12-8-10-3-4-11(12)7-10/h10-12,14H,2-9H2,1H3
InChIKeyLHCKPFVINVBIEH-UHFFFAOYSA-N
MW193.33 g/mol
LogP2.81
Rot. Bonds3

About 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine

1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine (PubChem CID 130494580) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine
PubChem CID130494580
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1(C2CC3CCC2C3)CCC1
InChIInChI=1S/C13H23N/c1-14-9-13(5-2-6-13)12-8-10-3-4-11(12)7-10/h10-12,14H,2-9H2,1H3
InChIKeyLHCKPFVINVBIEH-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]methanamine
CID 130494579
N-[[3-(2-bicyclo[2.2.1]heptanyl)-3-bicyclo[3.1.0]hexanyl]methyl]ethanamine
CID 114246431
N-methyl-1-[1-(oxetan-3-yl)cyclobutyl]methanamine
CID 116984973
1-(2-bicyclo[2.2.1]heptanyl)-4-ethylcyclohexan-1-ol
CID 72700642
N-[(1-methylsulfanylcyclobutyl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 107267219
N-[(1-propylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 115893902
(1S,3R,7R,8R)-tricyclo[5.2.1.03,8]decan-3-ol
CID 124785144
N-[(1-cyclopropylcyclopropyl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 115895728
2-[3-(chloromethyl)-1,2,2-trimethylcyclopropyl]bicyclo[2.2.1]heptane
CID 130609858
N-[[1-(2-bicyclo[2.2.1]heptanylmethyl)cyclohexyl]methyl]propan-1-amine
CID 79562942
N-[[1-(2-bicyclo[2.2.1]heptanylmethyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 79562303
tricyclo[4.2.1.03,7]nonan-3-ol
CID 4163021

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine?
The IUPAC name of 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine (CID 130494580) is 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine is CNCC1(C2CC3CCC2C3)CCC1.
What is the InChIKey of 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine?
The InChIKey is LHCKPFVINVBIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-14-9-13(5-2-6-13)12-8-10-3-4-11(12)7-10/h10-12,14H,2-9H2,1H3.
What are the key properties of 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine?
1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine has a molecular weight of 193.33 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-bicyclo[2.2.1]heptanyl)cyclobutyl]-N-methylmethanamine is sourced from PubChem (CID 130494580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).