2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine

C18H23N3 — CID 80797857

IUPAC2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine
SMILESCCCNc1cccc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C18H23N3/c1-2-12-19-17-8-5-9-18(21-17)20-16-11-10-14-6-3-4-7-15(14)13-16/h3-9,16H,2,10-13H2,1H3,(H2,19,20,21)
InChIKeyRZKVOAWTXJCKDT-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.87
Rot. Bonds5

About 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine

2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine (PubChem CID 80797857) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine
PubChem CID80797857
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine
SMILESCCCNc1cccc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C18H23N3/c1-2-12-19-17-8-5-9-18(21-17)20-16-11-10-14-6-3-4-7-15(14)13-16/h3-9,16H,2,10-13H2,1H3,(H2,19,20,21)
InChIKeyRZKVOAWTXJCKDT-UHFFFAOYSA-N
XLogP3.87
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(2,3-dihydro-1H-inden-2-yl)-2-N-propylpyridine-2,6-diamine
CID 107855439
6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 80798375
6-N-(2,3-dihydro-1H-inden-2-yl)-2-N-ethylpyridine-2,6-diamine
CID 107855387
6-N-cyclooctyl-2-N-propylpyridine-2,6-diamine
CID 80786169
N-propyl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-4-amine
CID 65403467
6-N-(2,3-dimethylcyclopentyl)-2-N-propylpyridine-2,6-diamine
CID 80840395
6-N-methyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 80825956
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridin-2-amine
CID 94392451
6-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyridine-2-carbothioamide
CID 64594883
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-2-amine
CID 60631928
6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,3,6-triamine
CID 79825418
2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 78988868

Frequently Asked Questions

What is the IUPAC name of 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine?
The IUPAC name of 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine (CID 80797857) is 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine?
The canonical SMILES for 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine is CCCNc1cccc(NC2CCc3ccccc3C2)n1.
What is the InChIKey of 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine?
The InChIKey is RZKVOAWTXJCKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-2-12-19-17-8-5-9-18(21-17)20-16-11-10-14-6-3-4-7-15(14)13-16/h3-9,16H,2,10-13H2,1H3,(H2,19,20,21).
What are the key properties of 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine?
2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine has a molecular weight of 281.40 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine is sourced from PubChem (CID 80797857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).