2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine

C14H15N3O — CID 62366962

IUPAC2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine
SMILESNc1cccnc1NC1CCOc2ccccc21
InChIInChI=1S/C14H15N3O/c15-11-5-3-8-16-14(11)17-12-7-9-18-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9,15H2,(H,16,17)
InChIKeyWHQOOCZGVMCTNT-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.60
Rot. Bonds2

About 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine

2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine (PubChem CID 62366962) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine
PubChem CID62366962
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine
SMILESNc1cccnc1NC1CCOc2ccccc21
InChIInChI=1S/C14H15N3O/c15-11-5-3-8-16-14(11)17-12-7-9-18-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9,15H2,(H,16,17)
InChIKeyWHQOOCZGVMCTNT-UHFFFAOYSA-N
XLogP2.60
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine
CID 115474076
N-(3,4-dihydro-2H-chromen-4-yl)-3-methylsulfonylpyridin-2-amine
CID 114598832
N-(3,4-dihydro-2H-chromen-4-yl)-2-methylpyridin-3-amine
CID 79042451
2-N-(3,4-dihydro-2H-chromen-4-yl)-3-methylbenzene-1,2-diamine
CID 115550430
N-(3,4-dihydro-2H-chromen-4-yl)-2-hydrazinylpyridin-4-amine
CID 113368245
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]pyrazin-2-amine
CID 94158654
6-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,6-diamine
CID 80647627
4-N-(3,4-dihydro-2H-chromen-4-yl)-2-N-methylpyrimidine-2,4-diamine
CID 80827015
2-N-(3,4-dihydro-2H-chromen-4-yl)-6-ethoxypyridine-2,5-diamine
CID 62365052
4-chloro-1-N-(3,4-dihydro-2H-chromen-4-yl)benzene-1,2-diamine
CID 62367304
1-N-(3,4-dihydro-2H-chromen-4-yl)-4-fluorobenzene-1,2-diamine
CID 62367472
N-(3,4-dihydro-2H-chromen-4-yl)-3-pyrrolidin-1-ylquinoxalin-2-amine
CID 108774221

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine?
The IUPAC name of 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine (CID 62366962) is 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine is Nc1cccnc1NC1CCOc2ccccc21.
What is the InChIKey of 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine?
The InChIKey is WHQOOCZGVMCTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-11-5-3-8-16-14(11)17-12-7-9-18-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9,15H2,(H,16,17).
What are the key properties of 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine?
2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine has a molecular weight of 241.29 g/mol, XLogP of 2.60, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine is sourced from PubChem (CID 62366962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).