5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine

C15H25N3 — CID 104535325

IUPAC5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine
SMILESCC(C)CCN(c1cncc(N)c1)C1CCCC1
InChIInChI=1S/C15H25N3/c1-12(2)7-8-18(14-5-3-4-6-14)15-9-13(16)10-17-11-15/h9-12,14H,3-8,16H2,1-2H3
InChIKeyGVDLBYHWVMHQDM-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.46
Rot. Bonds5

About 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine

5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine (PubChem CID 104535325) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine
PubChem CID104535325
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine
SMILESCC(C)CCN(c1cncc(N)c1)C1CCCC1
InChIInChI=1S/C15H25N3/c1-12(2)7-8-18(14-5-3-4-6-14)15-9-13(16)10-17-11-15/h9-12,14H,3-8,16H2,1-2H3
InChIKeyGVDLBYHWVMHQDM-UHFFFAOYSA-N
XLogP3.46
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-cyclopentyl-3-N-methyl-5-N-(3-methylbutyl)pyridine-3,5-diamine
CID 104535326
2-[(5-amino-3-pyridinyl)-cyclohexylamino]ethanol
CID 104533748
3-N-cyclopropyl-3-N-(3-methylbutyl)-5-nitrobenzene-1,3-diamine
CID 80820379
5-N-cyclopropyl-5-N-(3-methylbutyl)-3-N-propylpyridine-3,5-diamine
CID 104533791
3-N-cyclopentyl-3-N-(3-methylbutyl)pyrazine-2,3-diamine
CID 102986844
2-amino-4-[cyclopentyl(3-methylbutyl)amino]benzoic acid
CID 104500779
5-bromo-3-chloro-N-cyclopentyl-N-(3-methylbutyl)pyridin-2-amine
CID 103583405
4-N-cyclopentyl-4-N-(3-methylbutyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80960192
(1R)-1-[5-[cyclopentyl(3-methylbutyl)amino]-2-pyridinyl]propan-1-ol
CID 103938891
5-(bromomethyl)-N-cyclopentyl-N-(3-methylbutyl)pyrimidin-2-amine
CID 107084638
4-N-cyclopentyl-5-ethyl-4-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 80854897
2-N-cyclopropyl-5-methyl-2-N-(3-methylbutyl)pyridine-2,4-diamine
CID 83265339

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine?
The IUPAC name of 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine (CID 104535325) is 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine is CC(C)CCN(c1cncc(N)c1)C1CCCC1.
What is the InChIKey of 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine?
The InChIKey is GVDLBYHWVMHQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-12(2)7-8-18(14-5-3-4-6-14)15-9-13(16)10-17-11-15/h9-12,14H,3-8,16H2,1-2H3.
What are the key properties of 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine?
5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine has a molecular weight of 247.39 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopentyl-5-N-(3-methylbutyl)pyridine-3,5-diamine is sourced from PubChem (CID 104535325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).