2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine

C15H17N3 — CID 83265215

IUPAC2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine
SMILESCc1cnc(Nc2ccc3c(c2)CCC3)cc1N
InChIInChI=1S/C15H17N3/c1-10-9-17-15(8-14(10)16)18-13-6-5-11-3-2-4-12(11)7-13/h5-9H,2-4H2,1H3,(H3,16,17,18)
InChIKeyCTDBWNOCKDEFMI-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.20
Rot. Bonds2

About 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine

2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine (PubChem CID 83265215) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine
PubChem CID83265215
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine
SMILESCc1cnc(Nc2ccc3c(c2)CCC3)cc1N
InChIInChI=1S/C15H17N3/c1-10-9-17-15(8-14(10)16)18-13-6-5-11-3-2-4-12(11)7-13/h5-9H,2-4H2,1H3,(H3,16,17,18)
InChIKeyCTDBWNOCKDEFMI-UHFFFAOYSA-N
XLogP3.20
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
1-(3,4-Dimethylphenyl)-3-(2-pyridinyl)thiourea
CID 2731041
1-(3-Methylphenyl)-3-(2-pyridinyl)thiourea
CID 2730970
Isoquinoline-1,7-diamine
CID 21862655
6-[(9H-fluoren-2-ylamino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CID 466230
N*2*-Phenethyl-N*4*-((S)-1-phenyl-ethyl)-pyridine-2,4-diamine
CID 44393091
2-N-[2-(4-fluorophenyl)ethyl]-4-N-[(1S)-1-phenylethyl]pyridine-2,4-diamine
CID 44393092
N-(3,4-dimethylphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
CID 972661
Dimethyl{4-[(2-pyridylamino)methyl]phenyl}amine
CID 975588
N-(2,3-dimethylphenyl)-N'-2-pyridinylurea
CID 6465533
1-(2,3-Dimethylphenyl)-3-pyridin-2-ylthiourea
CID 800382
[2-(3,4-Dihydro-1H-isoquinolin-2-yl)-pyridin-4-yl]-methyl-amine
CID 9813501

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine?
The IUPAC name of 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine (CID 83265215) is 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine.
What is the SMILES notation for 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine?
The canonical SMILES for 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine is Cc1cnc(Nc2ccc3c(c2)CCC3)cc1N.
What is the InChIKey of 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine?
The InChIKey is CTDBWNOCKDEFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-10-9-17-15(8-14(10)16)18-13-6-5-11-3-2-4-12(11)7-13/h5-9H,2-4H2,1H3,(H3,16,17,18).
What are the key properties of 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine?
2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine has a molecular weight of 239.32 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,3-dihydro-1H-inden-5-yl)-5-methylpyridine-2,4-diamine is sourced from PubChem (CID 83265215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).