2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine

C14H26N4 — CID 79173924

IUPAC2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine
SMILESCc1cc(NCCN(C(C)C)C(C)C)ncc1N
InChIInChI=1S/C14H26N4/c1-10(2)18(11(3)4)7-6-16-14-8-12(5)13(15)9-17-14/h8-11H,6-7,15H2,1-5H3,(H,16,17)
InChIKeyRRMVCDUOXWWWST-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.50
Rot. Bonds6

About 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine

2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine (PubChem CID 79173924) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine
PubChem CID79173924
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine
SMILESCc1cc(NCCN(C(C)C)C(C)C)ncc1N
InChIInChI=1S/C14H26N4/c1-10(2)18(11(3)4)7-6-16-14-8-12(5)13(15)9-17-14/h8-11H,6-7,15H2,1-5H3,(H,16,17)
InChIKeyRRMVCDUOXWWWST-UHFFFAOYSA-N
XLogP2.50
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(5-amino-4-methyl-2-pyridinyl)amino]pentan-2-ol
CID 106119726
4-methyl-2-N-(2-methylsulfanylethyl)pyridine-2,5-diamine
CID 79176053
4-methyl-2-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2,5-diamine
CID 115147478
4-methyl-2-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2,5-diamine
CID 106413974
4-methyl-2-N-[2-(3-methylthiophen-2-yl)ethyl]pyridine-2,5-diamine
CID 115147485
N-(4-methoxy-2-pyridinyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 12857633
N-[6-(3-aminophenyl)pyrimidin-4-yl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 117091031
4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
CID 79173415
4-methyl-2-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
CID 79176329
2-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-methylpyridine-2,5-diamine
CID 114536202
2-N-[2-[di(propan-2-yl)amino]ethyl]-3-methylbenzene-1,2-diamine
CID 113333660
2-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpyridine-2,5-diamine
CID 79172913

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine?
The IUPAC name of 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine (CID 79173924) is 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine?
The canonical SMILES for 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine is Cc1cc(NCCN(C(C)C)C(C)C)ncc1N.
What is the InChIKey of 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine?
The InChIKey is RRMVCDUOXWWWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-10(2)18(11(3)4)7-6-16-14-8-12(5)13(15)9-17-14/h8-11H,6-7,15H2,1-5H3,(H,16,17).
What are the key properties of 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine?
2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine is sourced from PubChem (CID 79173924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).