N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine

C16H22N6 — CID 171350063

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine
SMILESCN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nc2)CC1
InChIInChI=1S/C16H22N6/c1-21-6-8-22(9-7-21)13-4-5-15(17-11-13)18-16-10-14(19-20-16)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H2,17,18,19,20)
InChIKeyKZFQBLCGGNQGEG-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.18
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine (PubChem CID 171350063) has the molecular formula C16H22N6 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine
PubChem CID171350063
Molecular FormulaC16H22N6
Molecular Weight298.39 g/mol
Exact Mass298.19
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine
SMILESCN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nc2)CC1
InChIInChI=1S/C16H22N6/c1-21-6-8-22(9-7-21)13-4-5-15(17-11-13)18-16-10-14(19-20-16)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H2,17,18,19,20)
InChIKeyKZFQBLCGGNQGEG-UHFFFAOYSA-N
XLogP2.18
TPSA60.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]hydroxylamine
CID 142567302
3-cyclopentyl-2-methyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]thieno[2,3-c]pyridin-5-amine
CID 145343369
5-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-2-amine
CID 90810476
N-(5-cyclopentyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)-2-phenylsulfanylpyrimidin-4-amine
CID 138644146
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-fluoro-2-N-(1-methylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 170298164
1-[2-(azetidin-3-yl)ethyl]-7-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]-2H-1,6-naphthyridin-2-ol
CID 170013720
1-(6-chloro-3-pyridinyl)-4-methylpiperazine
CID 75355748
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
CID 151602434
N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-2-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 118446914
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[3-[(1S)-2,2-dimethylcyclopropyl]pyrrolidin-1-yl]pyrimidin-4-amine
CID 170132228
2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
CID 47215724
cis-(1R,3S)-3-[3-[(1-methyl-2,2-dioxo-3H-2,1-benzothiazol-5-yl)amino]-1H-pyrazol-5-yl]cyclopentan-1-ol
CID 170623566

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine (CID 171350063) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine is CN1CCN(c2ccc(Nc3cc(C4CC4)[nH]n3)nc2)CC1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine?
The InChIKey is KZFQBLCGGNQGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6/c1-21-6-8-22(9-7-21)13-4-5-15(17-11-13)18-16-10-14(19-20-16)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H2,17,18,19,20).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine has a molecular weight of 298.39 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-5-(4-methylpiperazin-1-yl)pyridin-2-amine is sourced from PubChem (CID 171350063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).