6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

C16H11N5O2 — CID 627740

IUPAC6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SMILESN#CC1=C(N)Oc2n[nH]c(-c3ccccn3)c2C1c1ccco1
InChIInChI=1S/C16H11N5O2/c17-8-9-12(11-5-3-7-22-11)13-14(10-4-1-2-6-19-10)20-21-16(13)23-15(9)18/h1-7,12H,18H2,(H,20,21)
InChIKeyBIPRWLOWRVUGCE-UHFFFAOYSA-N
MW305.30 g/mol
LogP2.28
Rot. Bonds2

About 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (PubChem CID 627740) has the molecular formula C16H11N5O2 and a molecular weight of 305.30 g/mol. Its IUPAC name is 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.

Molecular Properties

Compound Name6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
PubChem CID627740
Molecular FormulaC16H11N5O2
Molecular Weight305.30 g/mol
Exact Mass305.09
IUPAC Name6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SMILESN#CC1=C(N)Oc2n[nH]c(-c3ccccn3)c2C1c1ccco1
InChIInChI=1S/C16H11N5O2/c17-8-9-12(11-5-3-7-22-11)13-14(10-4-1-2-6-19-10)20-21-16(13)23-15(9)18/h1-7,12H,18H2,(H,20,21)
InChIKeyBIPRWLOWRVUGCE-UHFFFAOYSA-N
XLogP2.28
TPSA113.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.30
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The IUPAC name of 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile (CID 627740) is 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
What is the SMILES notation for 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The canonical SMILES for 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is N#CC1=C(N)Oc2n[nH]c(-c3ccccn3)c2C1c1ccco1.
What is the InChIKey of 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
The InChIKey is BIPRWLOWRVUGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N5O2/c17-8-9-12(11-5-3-7-22-11)13-14(10-4-1-2-6-19-10)20-21-16(13)23-15(9)18/h1-7,12H,18H2,(H,20,21).
What are the key properties of 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile?
6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile has a molecular weight of 305.30 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-(furan-2-yl)-3-pyridin-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile is sourced from PubChem (CID 627740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).