2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine

C13H24N4 — CID 114133124

IUPAC2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine
SMILESCCCN(CC)CCNc1ncc(C)cc1N
InChIInChI=1S/C13H24N4/c1-4-7-17(5-2)8-6-15-13-12(14)9-11(3)10-16-13/h9-10H,4-8,14H2,1-3H3,(H,15,16)
InChIKeyQYNQUUKZABSEMP-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.12
Rot. Bonds7

About 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine

2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine (PubChem CID 114133124) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine
PubChem CID114133124
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine
SMILESCCCN(CC)CCNc1ncc(C)cc1N
InChIInChI=1S/C13H24N4/c1-4-7-17(5-2)8-6-15-13-12(14)9-11(3)10-16-13/h9-10H,4-8,14H2,1-3H3,(H,15,16)
InChIKeyQYNQUUKZABSEMP-UHFFFAOYSA-N
XLogP2.12
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-5-methylpyridine-2,3-diamine
CID 66281077
N-(3,6-dimethylpyrazin-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine
CID 114134141
2-N-(2-butoxyethyl)-5-methylpyridine-2,3-diamine
CID 66278004
3-[(3-amino-5-methyl-2-pyridinyl)amino]-N-propylpropanamide
CID 66281292
4-[(3-amino-5-methyl-2-pyridinyl)amino]butan-2-ol
CID 66278456
3-[(3-amino-5-methyl-2-pyridinyl)amino]-N,N-dimethylpropanamide
CID 66280637
4-N-[2-[ethyl(propyl)amino]ethyl]benzene-1,2,4-triamine
CID 114133127
2-N-[2-(diethylamino)ethyl]pyridine-2,3-diamine
CID 28818395
2-[(3-amino-5-methyl-2-pyridinyl)amino]ethyl carbamate
CID 83202225
2-N-(2-imidazol-1-ylethyl)-5-methylpyridine-2,3-diamine
CID 66280404
2-N-ethyl-5-methyl-2-N-propylpyridine-2,3-diamine
CID 66278862
2-N-[(2R)-butan-2-yl]-5-methylpyridine-2,3-diamine
CID 93204113

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine?
The IUPAC name of 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine (CID 114133124) is 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine?
The canonical SMILES for 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine is CCCN(CC)CCNc1ncc(C)cc1N.
What is the InChIKey of 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine?
The InChIKey is QYNQUUKZABSEMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-7-17(5-2)8-6-15-13-12(14)9-11(3)10-16-13/h9-10H,4-8,14H2,1-3H3,(H,15,16).
What are the key properties of 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine?
2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine has a molecular weight of 236.36 g/mol, XLogP of 2.12, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-[ethyl(propyl)amino]ethyl]-5-methylpyridine-2,3-diamine is sourced from PubChem (CID 114133124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).