3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine

C11H19N3 — CID 104539955

IUPAC3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine
SMILESCCC(CC)N(C)c1cccnc1N
InChIInChI=1S/C11H19N3/c1-4-9(5-2)14(3)10-7-6-8-13-11(10)12/h6-9H,4-5H2,1-3H3,(H2,12,13)
InChIKeyJFIYAWMFGFCSIJ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.29
Rot. Bonds4

About 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine

3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine (PubChem CID 104539955) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine
PubChem CID104539955
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine
SMILESCCC(CC)N(C)c1cccnc1N
InChIInChI=1S/C11H19N3/c1-4-9(5-2)14(3)10-7-6-8-13-11(10)12/h6-9H,4-5H2,1-3H3,(H2,12,13)
InChIKeyJFIYAWMFGFCSIJ-UHFFFAOYSA-N
XLogP2.29
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3,3-dimethylbutan-2-yl)-3-N-methylpyridine-2,3-diamine
CID 104540178
3-N,3-N-diethylpyridine-2,3-diamine
CID 54572211
3-[amino(propan-2-yl)amino]pyridin-2-amine
CID 167189595
4-N-methyl-4-N-pentan-3-ylquinoline-4,8-diamine
CID 83060957
6-N-methyl-6-N-pentan-3-ylpyridine-2,3,6-triamine
CID 79828067
3-[(2-amino-3-pyridinyl)-methylamino]propanenitrile
CID 104539719
3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)pyridine-2,3-diamine
CID 104540169
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912
2-[(2-amino-3-pyridinyl)-(2-hydroxyethyl)amino]ethanol
CID 104540016
3-N-(cyclohexylmethyl)-3-N-methylpyridine-2,3-diamine
CID 104540064
3-amino-1-(2-amino-3-pyridinyl)-1-methylurea
CID 3330766
3-[(3S)-2-methylpentan-3-yl]pyridin-2-amine
CID 176663633

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine?
The IUPAC name of 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine (CID 104539955) is 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine.
What is the SMILES notation for 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine?
The canonical SMILES for 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine is CCC(CC)N(C)c1cccnc1N.
What is the InChIKey of 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine?
The InChIKey is JFIYAWMFGFCSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-9(5-2)14(3)10-7-6-8-13-11(10)12/h6-9H,4-5H2,1-3H3,(H2,12,13).
What are the key properties of 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine?
3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine has a molecular weight of 193.29 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 3-N-methyl-3-N-pentan-3-ylpyridine-2,3-diamine is sourced from PubChem (CID 104539955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).