N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine

C15H24N2 — CID 80522808

IUPACN-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
SMILESCCC1CC(CNC(C)C)(c2cccnc2)C1
InChIInChI=1S/C15H24N2/c1-4-13-8-15(9-13,11-17-12(2)3)14-6-5-7-16-10-14/h5-7,10,12-13,17H,4,8-9,11H2,1-3H3
InChIKeyMVOQLAJAROEFCS-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.14
Rot. Bonds5

About N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine

N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine (PubChem CID 80522808) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
PubChem CID80522808
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
SMILESCCC1CC(CNC(C)C)(c2cccnc2)C1
InChIInChI=1S/C15H24N2/c1-4-13-8-15(9-13,11-17-12(2)3)14-6-5-7-16-10-14/h5-7,10,12-13,17H,4,8-9,11H2,1-3H3
InChIKeyMVOQLAJAROEFCS-UHFFFAOYSA-N
XLogP3.14
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(3-propyl-1-pyridin-3-ylcyclobutyl)methanamine
CID 80522419
N-[[1-(2,6-dichlorophenyl)-3-ethylcyclobutyl]methyl]propan-2-amine
CID 64997625
N-[[1-(4-ethoxyphenyl)-3-ethylcyclobutyl]methyl]propan-2-amine
CID 64997706
2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine
CID 80522198
2-methyl-N-[(1-pyridin-3-ylcyclohexyl)methyl]propan-1-amine
CID 80522632
N-methyl-1-(1-pyridin-3-ylcyclobutyl)methanamine
CID 80522291
N-[(3-ethyl-1-pyridin-4-ylcyclobutyl)methyl]ethanamine
CID 80525440
N-[(2-pyridin-3-ylspiro[3.3]heptan-2-yl)methyl]ethanamine
CID 80522715
2-methyl-N-[(2-methyl-2-pyridin-3-ylcyclopropyl)methyl]propan-1-amine
CID 62714424
N-[[1-(3,5-dimethylphenyl)-3-propylcyclobutyl]methyl]propan-2-amine
CID 65011194
N-[(1-phenylcyclohexyl)methyl]propan-2-amine
CID 62596577
3-propan-2-yl-1-pyridin-3-ylcyclobutan-1-ol
CID 103564024

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The IUPAC name of N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine (CID 80522808) is N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine.
What is the SMILES notation for N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The canonical SMILES for N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine is CCC1CC(CNC(C)C)(c2cccnc2)C1.
What is the InChIKey of N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The InChIKey is MVOQLAJAROEFCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-13-8-15(9-13,11-17-12(2)3)14-6-5-7-16-10-14/h5-7,10,12-13,17H,4,8-9,11H2,1-3H3.
What are the key properties of N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine has a molecular weight of 232.37 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine is sourced from PubChem (CID 80522808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).