5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine

C13H22N4 — CID 104534598

IUPAC5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine
SMILESCN(CCNc1cncc(N)c1)C1CCCC1
InChIInChI=1S/C13H22N4/c1-17(13-4-2-3-5-13)7-6-16-12-8-11(14)9-15-10-12/h8-10,13,16H,2-7,14H2,1H3
InChIKeyZEMHPXKTGPYHOC-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.95
Rot. Bonds5

About 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine

5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine (PubChem CID 104534598) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine
PubChem CID104534598
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine
SMILESCN(CCNc1cncc(N)c1)C1CCCC1
InChIInChI=1S/C13H22N4/c1-17(13-4-2-3-5-13)7-6-16-12-8-11(14)9-15-10-12/h8-10,13,16H,2-7,14H2,1H3
InChIKeyZEMHPXKTGPYHOC-UHFFFAOYSA-N
XLogP1.95
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-[2-[cyclopentyl(methyl)amino]ethyl]-3-N-propylpyridine-3,5-diamine
CID 104534597
N-(5-bromo-3-pyridinyl)-N'-cyclopentyl-N'-methylethane-1,2-diamine
CID 113423561
4-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylbenzene-1,4-diamine
CID 63314722
1-N-[2-[cyclopentyl(methyl)amino]ethyl]-2,6-difluorobenzene-1,4-diamine
CID 55203728
N'-cyclopentyl-N-(6-hydrazinylpyrazin-2-yl)-N'-methylethane-1,2-diamine
CID 80914281
N'-cyclopentyl-N'-methyl-N-(2-methyl-4-pyridinyl)ethane-1,2-diamine
CID 113482625
4-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methoxybenzene-1,4-diamine
CID 63675933
N'-cyclopentyl-N-(5-fluoropyrimidin-2-yl)-N'-methylethane-1,2-diamine
CID 112703177
4-N-[2-[cyclopentyl(methyl)amino]ethyl]-6-N-propylpyrimidine-2,4,6-triamine
CID 80814858
5-[2-[cyclopentyl(methyl)amino]ethylamino]pyridine-2-carbonitrile
CID 115487694
5-N-[4-[methyl(propan-2-yl)amino]butyl]pyridine-3,5-diamine
CID 104534054
N'-cyclopentyl-N-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 63317997

Frequently Asked Questions

What is the IUPAC name of 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine?
The IUPAC name of 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine (CID 104534598) is 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine.
What is the SMILES notation for 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine?
The canonical SMILES for 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine is CN(CCNc1cncc(N)c1)C1CCCC1.
What is the InChIKey of 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine?
The InChIKey is ZEMHPXKTGPYHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-17(13-4-2-3-5-13)7-6-16-12-8-11(14)9-15-10-12/h8-10,13,16H,2-7,14H2,1H3.
What are the key properties of 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine?
5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine has a molecular weight of 234.35 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3,5-diamine is sourced from PubChem (CID 104534598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).