(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile

C15H15N5O — CID 839953

IUPAC(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile
SMILESCCCc1nc2c([nH]1)[C@H](c1cccnc1)C(C#N)=C(N)O2
InChIInChI=1S/C15H15N5O/c1-2-4-11-19-13-12(9-5-3-6-18-8-9)10(7-16)14(17)21-15(13)20-11/h3,5-6,8,12H,2,4,17H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyUSQLMWVPFUWNPE-GFCCVEGCSA-N
MW281.32 g/mol
LogP1.98
Rot. Bonds3

About (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile

(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile (PubChem CID 839953) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile.

Molecular Properties

Compound Name(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile
PubChem CID839953
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile
SMILESCCCc1nc2c([nH]1)[C@H](c1cccnc1)C(C#N)=C(N)O2
InChIInChI=1S/C15H15N5O/c1-2-4-11-19-13-12(9-5-3-6-18-8-9)10(7-16)14(17)21-15(13)20-11/h3,5-6,8,12H,2,4,17H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyUSQLMWVPFUWNPE-GFCCVEGCSA-N
XLogP1.98
TPSA100.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

6-amino-3-methyl-4-pyridin-3-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 600130
5-amino-7-pyridin-3-yl-2-(trifluoromethyl)-1,7-dihydropyrano[2,3-d]imidazol-3-ium-6-carbonitrile
CID 3314295
(4S)-2-amino-6-tert-butyl-4-pyridin-3-yl-4H-pyran-3,5-dicarbonitrile
CID 703560
(4R)-6-amino-4-pyridin-3-yl-3-(trifluoromethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 676000
3-amino-1-pyridin-3-yl-1H-benzo[f]chromene-2-carbonitrile
CID 2839492
4,7-diamino-2-prop-2-ynylsulfanyl-5-pyridin-3-yl-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
CID 5295384
tert-butyl 6-amino-5-cyano-2-methyl-4-pyridin-3-yl-4H-pyran-3-carboxylate
CID 5236789
2-amino-6-[2-(dimethylamino)ethyl]-5-oxo-7-propyl-4-pyridin-3-yl-4H-pyrano[3,2-c]pyridine-3-carbonitrile
CID 23475734
(4S)-6-amino-4-pyridin-3-yl-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
CID 728973
2-amino-7-hydroxy-8-methyl-4-pyridin-3-yl-4H-chromene-3-carbonitrile
CID 3137559
12-amino-4-(ethylamino)-8-oxo-10-pyridin-3-yl-13-oxa-3-thia-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6),4,11-tetraene-5,11-dicarbonitrile
CID 16766844
4-amino-11,13-dimethyl-6-pyridin-3-yl-3-oxa-8-thia-10-azatricyclo[7.4.0.02,7]trideca-1(9),2(7),4,10,12-pentaene-5-carbonitrile
CID 11838460

Frequently Asked Questions

What is the IUPAC name of (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile?
The IUPAC name of (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile (CID 839953) is (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile.
What is the SMILES notation for (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile?
The canonical SMILES for (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile is CCCc1nc2c([nH]1)[C@H](c1cccnc1)C(C#N)=C(N)O2.
What is the InChIKey of (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile?
The InChIKey is USQLMWVPFUWNPE-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H15N5O/c1-2-4-11-19-13-12(9-5-3-6-18-8-9)10(7-16)14(17)21-15(13)20-11/h3,5-6,8,12H,2,4,17H2,1H3,(H,19,20)/t12-/m1/s1.
What are the key properties of (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile?
(7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile has a molecular weight of 281.32 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-5-amino-2-propyl-7-pyridin-3-yl-1,7-dihydropyrano[2,3-d]imidazole-6-carbonitrile is sourced from PubChem (CID 839953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).