5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine

C10H17N3 — CID 43272602

IUPAC5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine
SMILESCCC(C)N(C)c1ccc(N)nc1
InChIInChI=1S/C10H17N3/c1-4-8(2)13(3)9-5-6-10(11)12-7-9/h5-8H,4H2,1-3H3,(H2,11,12)
InChIKeyDBIZKMWDKUMXNL-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.90
Rot. Bonds3

About 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine

5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine (PubChem CID 43272602) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine
PubChem CID43272602
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine
SMILESCCC(C)N(C)c1ccc(N)nc1
InChIInChI=1S/C10H17N3/c1-4-8(2)13(3)9-5-6-10(11)12-7-9/h5-8H,4H2,1-3H3,(H2,11,12)
InChIKeyDBIZKMWDKUMXNL-UHFFFAOYSA-N
XLogP1.90
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(aminomethyl)-N-butan-2-yl-N-methylpyridin-3-amine
CID 115486842
6-(aminomethyl)-N-methyl-N-pentan-3-ylpyridin-3-amine
CID 115486871
3-N-butan-2-yl-3-N-methylbenzene-1,3-diamine
CID 43272599
6-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-3-amine
CID 115486936
5-N-methoxy-5-N-(2-methylpropyl)pyridine-2,5-diamine
CID 87841312
N-(6-amino-3-pyridinyl)-N-methylbutanamide
CID 115268400
5-N-methyl-5-N-prop-2-enylpyridine-2,5-diamine
CID 83635531
6-(aminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-3-amine
CID 115486870
2-[(6-amino-3-pyridinyl)-methylamino]acetamide
CID 43374025
2-(aminomethyl)-N-butan-2-yl-N-methylpyridin-4-amine
CID 62300854
2-N-butan-2-yl-2-N-ethylpyrazine-2,5-diamine
CID 80652510
5-[[butan-2-yl(ethyl)amino]methyl]pyrazin-2-amine
CID 103055611

Frequently Asked Questions

What is the IUPAC name of 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine?
The IUPAC name of 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine (CID 43272602) is 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine?
The canonical SMILES for 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine is CCC(C)N(C)c1ccc(N)nc1.
What is the InChIKey of 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine?
The InChIKey is DBIZKMWDKUMXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-4-8(2)13(3)9-5-6-10(11)12-7-9/h5-8H,4H2,1-3H3,(H2,11,12).
What are the key properties of 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine?
5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine has a molecular weight of 179.27 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-butan-2-yl-5-N-methylpyridine-2,5-diamine is sourced from PubChem (CID 43272602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).