4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile

C15H13N3 — CID 107850570

IUPAC4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(NC2Cc3ccccc3C2)ccn1
InChIInChI=1S/C15H13N3/c16-10-15-9-13(5-6-17-15)18-14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14H,7-8H2,(H,17,18)
InChIKeySDZPVDDOMBPHHR-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.53
Rot. Bonds2

About 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile

4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile (PubChem CID 107850570) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile
PubChem CID107850570
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(NC2Cc3ccccc3C2)ccn1
InChIInChI=1S/C15H13N3/c16-10-15-9-13(5-6-17-15)18-14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14H,7-8H2,(H,17,18)
InChIKeySDZPVDDOMBPHHR-UHFFFAOYSA-N
XLogP2.53
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-inden-2-yl)-2-fluoropyridin-4-amine
CID 107854173
4-[(1-methylazetidin-3-yl)amino]pyridine-2-carbonitrile
CID 130670429
4-(oxan-4-ylamino)pyridine-2-carbonitrile
CID 62924649
4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carboxylic acid
CID 107853442
4-[(1-ethylpiperidin-4-yl)amino]pyridine-2-carbonitrile
CID 62924829
4-(2,3-dihydro-1H-inden-2-ylamino)-2-fluorobenzonitrile
CID 107853110
4-(methylamino)pyridine-2-carbonitrile
CID 45079907
[(1R,3S)-3-[(2-cyano-4-pyridinyl)amino]cyclohexyl]carbamic acid
CID 174225540
4-hydrazinylpyridine-2-carbonitrile
CID 62925156
2-(2,3-dihydro-1H-inden-2-ylamino)-4-methylpyridine-3-carbonitrile
CID 104695734
2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyridine-4-carbonitrile
CID 62306308
N-(3,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 43512824

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile?
The IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile (CID 107850570) is 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile is N#Cc1cc(NC2Cc3ccccc3C2)ccn1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile?
The InChIKey is SDZPVDDOMBPHHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c16-10-15-9-13(5-6-17-15)18-14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14H,7-8H2,(H,17,18).
What are the key properties of 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile?
4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile has a molecular weight of 235.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-2-ylamino)pyridine-2-carbonitrile is sourced from PubChem (CID 107850570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).