6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine

C12H19N3 — CID 107402993

IUPAC6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine
SMILESCCN(CC1CCC1)c1cccc(N)n1
InChIInChI=1S/C12H19N3/c1-2-15(9-10-5-3-6-10)12-8-4-7-11(13)14-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H2,13,14)
InChIKeyOWIZMTJFDYQSES-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.29
Rot. Bonds4

About 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine

6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine (PubChem CID 107402993) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine
PubChem CID107402993
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine
SMILESCCN(CC1CCC1)c1cccc(N)n1
InChIInChI=1S/C12H19N3/c1-2-15(9-10-5-3-6-10)12-8-4-7-11(13)14-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H2,13,14)
InChIKeyOWIZMTJFDYQSES-UHFFFAOYSA-N
XLogP2.29
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(cyclopropylmethyl)-6-N-propylpyridine-2,6-diamine
CID 80647313
6-N-(cyclopentylmethyl)-6-N-methylpyridine-2,6-diamine
CID 80653540
[6-[cyclobutylmethyl(ethyl)amino]-2-pyridinyl]methanol
CID 107400665
6-N-ethyl-6-N-(oxolan-2-ylmethyl)pyridine-2,6-diamine
CID 80646622
N-(cyclopropylmethyl)-N-ethyl-6-hydrazinylpyridin-2-amine
CID 80913288
2-N-(cyclobutylmethyl)-2-N-ethylpyrazine-2,5-diamine
CID 107402995
6-N-ethyl-6-N-(2-ethylbutyl)pyridine-2,6-diamine
CID 80648336
2-N-(cyclobutylmethyl)-2-N-ethyl-6-(2-methylpropoxy)pyridine-2,5-diamine
CID 107397151
6-N-(cyclopropylmethyl)-6-N-ethyl-2-N-propylpyridine-2,6-diamine
CID 80838817
4-(aminomethyl)-N-(cyclobutylmethyl)-N-ethylquinolin-2-amine
CID 107397272
4-N-(cyclobutylmethyl)-4-N-ethylpyridine-3,4-diamine
CID 107397217
4-N-(cyclobutylmethyl)-4-N-ethyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 107403126

Frequently Asked Questions

What is the IUPAC name of 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine?
The IUPAC name of 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine (CID 107402993) is 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine is CCN(CC1CCC1)c1cccc(N)n1.
What is the InChIKey of 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine?
The InChIKey is OWIZMTJFDYQSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-2-15(9-10-5-3-6-10)12-8-4-7-11(13)14-12/h4,7-8,10H,2-3,5-6,9H2,1H3,(H2,13,14).
What are the key properties of 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine?
6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine has a molecular weight of 205.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(cyclobutylmethyl)-6-N-ethylpyridine-2,6-diamine is sourced from PubChem (CID 107402993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).