4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine

C15H20N4 — CID 106996102

IUPAC4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine
SMILESCc1nnc(NC2CCNC(C)C2)c2ccccc12
InChIInChI=1S/C15H20N4/c1-10-9-12(7-8-16-10)17-15-14-6-4-3-5-13(14)11(2)18-19-15/h3-6,10,12,16H,7-9H2,1-2H3,(H,17,19)
InChIKeyRKXGZJPGUMJAQJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.49
Rot. Bonds2

About 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine

4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine (PubChem CID 106996102) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine
PubChem CID106996102
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine
SMILESCc1nnc(NC2CCNC(C)C2)c2ccccc12
InChIInChI=1S/C15H20N4/c1-10-9-12(7-8-16-10)17-15-14-6-4-3-5-13(14)11(2)18-19-15/h3-6,10,12,16H,7-9H2,1-2H3,(H,17,19)
InChIKeyRKXGZJPGUMJAQJ-UHFFFAOYSA-N
XLogP2.49
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethylsulfanylcyclopentyl)-4-methylphthalazin-1-amine
CID 103704778
N-(4-ethylcyclohexyl)-4-methylphthalazin-1-amine
CID 63540102
N-(2,2-dimethylcyclopropyl)-4-methylphthalazin-1-amine
CID 61222397
2-[4-[(4-methylphthalazin-1-yl)amino]cyclohexyl]pyridazin-3-one
CID 126934424
3-methyl-N-(2-methylpiperidin-4-yl)pyridin-4-amine
CID 106995966
5-chloro-N-(2-methylpiperidin-4-yl)pyrimidin-4-amine
CID 106996173
4-methyl-N-[(2-methylcyclohexyl)methyl]phthalazin-1-amine
CID 63541033
5-methoxy-4-[(2-methylpiperidin-4-yl)amino]-1H-pyrimidin-6-one
CID 136778289
2-methyl-N-(2-methylpiperidin-4-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106996052
N-ethyl-4-methylphthalazin-1-amine
CID 43395120
trans-(1R,3R)-3-[(4-chlorophthalazin-1-yl)amino]cyclopentan-1-ol
CID 167292889
5-bromo-N-(2-methylpiperidin-4-yl)pyrimidin-2-amine
CID 106996112

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine?
The IUPAC name of 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine (CID 106996102) is 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine.
What is the SMILES notation for 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine?
The canonical SMILES for 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine is Cc1nnc(NC2CCNC(C)C2)c2ccccc12.
What is the InChIKey of 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine?
The InChIKey is RKXGZJPGUMJAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-9-12(7-8-16-10)17-15-14-6-4-3-5-13(14)11(2)18-19-15/h3-6,10,12,16H,7-9H2,1-2H3,(H,17,19).
What are the key properties of 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine?
4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine has a molecular weight of 256.35 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpiperidin-4-yl)phthalazin-1-amine is sourced from PubChem (CID 106996102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).