N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine

C11H16N4 — CID 59619097

IUPACN-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCC[C@H](C)Nc1nccc2n[nH]c(C)c12
InChIInChI=1S/C11H16N4/c1-4-7(2)13-11-10-8(3)14-15-9(10)5-6-12-11/h5-7H,4H2,1-3H3,(H,12,13)(H,14,15)/t7-/m0/s1
InChIKeyWMBMFNBXMGAYOE-ZETCQYMHSA-N
MW204.28 g/mol
LogP2.48
Rot. Bonds3

About N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine

N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine (PubChem CID 59619097) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
PubChem CID59619097
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC NameN-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCC[C@H](C)Nc1nccc2n[nH]c(C)c12
InChIInChI=1S/C11H16N4/c1-4-7(2)13-11-10-8(3)14-15-9(10)5-6-12-11/h5-7H,4H2,1-3H3,(H,12,13)(H,14,15)/t7-/m0/s1
InChIKeyWMBMFNBXMGAYOE-ZETCQYMHSA-N
XLogP2.48
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine (CID 59619097) is N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine is CC[C@H](C)Nc1nccc2n[nH]c(C)c12.
What is the InChIKey of N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is WMBMFNBXMGAYOE-ZETCQYMHSA-N. The full InChI is InChI=1S/C11H16N4/c1-4-7(2)13-11-10-8(3)14-15-9(10)5-6-12-11/h5-7H,4H2,1-3H3,(H,12,13)(H,14,15)/t7-/m0/s1.
What are the key properties of N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 204.28 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-butan-2-yl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 59619097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).