N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine

C15H17N5 — CID 103908129

IUPACN-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine
SMILESCCc1nn(C)cc1Nc1nnc(C)c2ccccc12
InChIInChI=1S/C15H17N5/c1-4-13-14(9-20(3)19-13)16-15-12-8-6-5-7-11(12)10(2)17-18-15/h5-9H,4H2,1-3H3,(H,16,18)
InChIKeyLZMWNIOUJKLNLU-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.98
Rot. Bonds3

About N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine

N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine (PubChem CID 103908129) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine.

Molecular Properties

Compound NameN-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine
PubChem CID103908129
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine
SMILESCCc1nn(C)cc1Nc1nnc(C)c2ccccc12
InChIInChI=1S/C15H17N5/c1-4-13-14(9-20(3)19-13)16-15-12-8-6-5-7-11(12)10(2)17-18-15/h5-9H,4H2,1-3H3,(H,16,18)
InChIKeyLZMWNIOUJKLNLU-UHFFFAOYSA-N
XLogP2.98
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-methylphthalazin-1-amine
CID 115887018
3-[(3-ethyl-1-methylpyrazol-4-yl)amino]-5,6-dimethylpyridazine-4-carbonitrile
CID 103908152
4-methyl-N-naphthalen-1-ylphthalazin-1-amine
CID 1387760
6-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)-2,5-dimethylpyrimidin-4-amine
CID 107464313
N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpyridazin-3-amine
CID 107463688
N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpyridin-2-amine
CID 107463689
N-ethyl-4-methylphthalazin-1-amine
CID 43395120
3-N-(3-ethyl-1-methylpyrazol-4-yl)pyrazine-2,3-diamine
CID 107465112
2-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)-5-methylpyrimidin-4-amine
CID 107464314
(3-ethyl-1-methylpyrazol-4-yl)thiourea
CID 107462555
8-N-(3-ethyl-1-methylpyrazol-4-yl)quinoline-5,8-diamine
CID 107462124
3-ethyl-1-methyl-N-[(1-methylindol-3-yl)methyl]pyrazol-4-amine
CID 107462367

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine?
The IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine (CID 103908129) is N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine.
What is the SMILES notation for N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine?
The canonical SMILES for N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine is CCc1nn(C)cc1Nc1nnc(C)c2ccccc12.
What is the InChIKey of N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine?
The InChIKey is LZMWNIOUJKLNLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-4-13-14(9-20(3)19-13)16-15-12-8-6-5-7-11(12)10(2)17-18-15/h5-9H,4H2,1-3H3,(H,16,18).
What are the key properties of N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine?
N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine has a molecular weight of 267.34 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylphthalazin-1-amine is sourced from PubChem (CID 103908129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).