N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine

C19H21N5 — CID 68780511

IUPACN-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESC(=Cc1[nH]nc2ccnc(NC3CCCCC3)c12)c1ccncc1
InChIInChI=1S/C19H21N5/c1-2-4-15(5-3-1)22-19-18-16(23-24-17(18)10-13-21-19)7-6-14-8-11-20-12-9-14/h6-13,15H,1-5H2,(H,21,22)(H,23,24)
InChIKeyLQTOTADUJHQONL-UHFFFAOYSA-N
MW319.41 g/mol
LogP4.27
Rot. Bonds4

About N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine

N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine (PubChem CID 68780511) has the molecular formula C19H21N5 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine
PubChem CID68780511
Molecular FormulaC19H21N5
Molecular Weight319.41 g/mol
Exact Mass319.18
IUPAC NameN-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESC(=Cc1[nH]nc2ccnc(NC3CCCCC3)c12)c1ccncc1
InChIInChI=1S/C19H21N5/c1-2-4-15(5-3-1)22-19-18-16(23-24-17(18)10-13-21-19)7-6-14-8-11-20-12-9-14/h6-13,15H,1-5H2,(H,21,22)(H,23,24)
InChIKeyLQTOTADUJHQONL-UHFFFAOYSA-N
XLogP4.27
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine (CID 68780511) is N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine is C(=Cc1[nH]nc2ccnc(NC3CCCCC3)c12)c1ccncc1.
What is the InChIKey of N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is LQTOTADUJHQONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5/c1-2-4-15(5-3-1)22-19-18-16(23-24-17(18)10-13-21-19)7-6-14-8-11-20-12-9-14/h6-13,15H,1-5H2,(H,21,22)(H,23,24).
What are the key properties of N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine?
N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 319.41 g/mol, XLogP of 4.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(2-pyridin-4-ylethenyl)-2H-pyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 68780511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).