6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine

C17H23N3 — CID 104592500

IUPAC6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(NCC(C)c2ccccc2)n1
InChIInChI=1S/C17H23N3/c1-3-12-18-16-10-7-11-17(20-16)19-13-14(2)15-8-5-4-6-9-15/h4-11,14H,3,12-13H2,1-2H3,(H2,18,19,20)
InChIKeyBPHDYCORHXEBPO-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.12
Rot. Bonds7

About 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine

6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine (PubChem CID 104592500) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine
PubChem CID104592500
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(NCC(C)c2ccccc2)n1
InChIInChI=1S/C17H23N3/c1-3-12-18-16-10-7-11-17(20-16)19-13-14(2)15-8-5-4-6-9-15/h4-11,14H,3,12-13H2,1-2H3,(H2,18,19,20)
InChIKeyBPHDYCORHXEBPO-UHFFFAOYSA-N
XLogP4.12
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylpropyl)quinolin-2-amine
CID 115569576
6-N-[(4-propan-2-ylphenyl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80793098
6-N-[1-(3-chlorophenyl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80802405
6-N-pentan-3-yl-2-N-propylpyridine-2,6-diamine
CID 80770551
6-N-(7-methyloctyl)-2-N-propylpyridine-2,6-diamine
CID 107818930
6-N-(4-methylpentan-2-yl)-2-N-propylpyridine-2,6-diamine
CID 80783247
5-tert-butyl-N-(2-phenylpropyl)pyridin-2-amine
CID 107874865
N-(2-phenylpropyl)quinoxalin-2-amine
CID 47142875
N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine
CID 115599010
6-N-[1-(2-fluorophenyl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80802273
6-chloro-2-methyl-N-(2-phenylpropyl)pyrimidin-4-amine
CID 113230295
1-ethyl-N-(2-phenylpropyl)pyrazol-3-amine
CID 114251829

Frequently Asked Questions

What is the IUPAC name of 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine?
The IUPAC name of 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine (CID 104592500) is 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine is CCCNc1cccc(NCC(C)c2ccccc2)n1.
What is the InChIKey of 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine?
The InChIKey is BPHDYCORHXEBPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-12-18-16-10-7-11-17(20-16)19-13-14(2)15-8-5-4-6-9-15/h4-11,14H,3,12-13H2,1-2H3,(H2,18,19,20).
What are the key properties of 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine?
6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine has a molecular weight of 269.39 g/mol, XLogP of 4.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2-phenylpropyl)-2-N-propylpyridine-2,6-diamine is sourced from PubChem (CID 104592500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).