N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine

C15H25N3 — CID 81247485

IUPACN-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine
SMILESCCNCc1cnc(C)cc1N(C)CC1CCC1
InChIInChI=1S/C15H25N3/c1-4-16-9-14-10-17-12(2)8-15(14)18(3)11-13-6-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3
InChIKeyMUCUOSDPXXAULE-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.74
Rot. Bonds6

About N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine

N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine (PubChem CID 81247485) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine
PubChem CID81247485
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine
SMILESCCNCc1cnc(C)cc1N(C)CC1CCC1
InChIInChI=1S/C15H25N3/c1-4-16-9-14-10-17-12(2)8-15(14)18(3)11-13-6-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3
InChIKeyMUCUOSDPXXAULE-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine?
The IUPAC name of N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine (CID 81247485) is N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine?
The canonical SMILES for N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine is CCNCc1cnc(C)cc1N(C)CC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine?
The InChIKey is MUCUOSDPXXAULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-16-9-14-10-17-12(2)8-15(14)18(3)11-13-6-5-7-13/h8,10,13,16H,4-7,9,11H2,1-3H3.
What are the key properties of N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine?
N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine is sourced from PubChem (CID 81247485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).