4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine

C11H19N3 — CID 79173415

IUPAC4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
SMILESCCC(CC)Nc1cc(C)c(N)cn1
InChIInChI=1S/C11H19N3/c1-4-9(5-2)14-11-6-8(3)10(12)7-13-11/h6-7,9H,4-5,12H2,1-3H3,(H,13,14)
InChIKeyKPEIVJPUTWWTID-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.57
Rot. Bonds4

About 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine

4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine (PubChem CID 79173415) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine.

Molecular Properties

Compound Name4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
PubChem CID79173415
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
SMILESCCC(CC)Nc1cc(C)c(N)cn1
InChIInChI=1S/C11H19N3/c1-4-9(5-2)14-11-6-8(3)10(12)7-13-11/h6-7,9H,4-5,12H2,1-3H3,(H,13,14)
InChIKeyKPEIVJPUTWWTID-UHFFFAOYSA-N
XLogP2.57
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-pentan-3-ylpyridine-2,5-diamine
CID 16775519
4,6-dimethyl-3-N-pentan-3-ylbenzene-1,3-diamine
CID 104757851
4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
CID 79176056
5-bromo-N-pentan-3-ylpyridin-2-amine
CID 28553670
N-(5-amino-4-methyl-2-pyridinyl)acetamide
CID 22063573
2-N-[(4-ethylphenyl)methyl]-4-methylpyridine-2,5-diamine
CID 106899259
5-bromo-N-[(2S)-butan-2-yl]-4-methylpyridin-2-amine
CID 86323877
2-[(5-methyl-4-nitro-2-pyridinyl)amino]butan-1-ol
CID 83269513
2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine
CID 79173924
N-(5-amino-4-methyl-2-pyridinyl)-2-methylpropanamide
CID 18525004
4-methyl-2-N-(2-methylsulfanylethyl)pyridine-2,5-diamine
CID 79176053
2-N-[4-(furan-2-yl)butan-2-yl]-4-methylpyridine-2,5-diamine
CID 79173050

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine?
The IUPAC name of 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine (CID 79173415) is 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine.
What is the SMILES notation for 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine?
The canonical SMILES for 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine is CCC(CC)Nc1cc(C)c(N)cn1.
What is the InChIKey of 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine?
The InChIKey is KPEIVJPUTWWTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-9(5-2)14-11-6-8(3)10(12)7-13-11/h6-7,9H,4-5,12H2,1-3H3,(H,13,14).
What are the key properties of 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine?
4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine has a molecular weight of 193.29 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine is sourced from PubChem (CID 79173415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).