5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine

C13H22N4 — CID 54963421

IUPAC5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine
SMILESCCCN1CCC(Nc2ccc(N)nc2)CC1
InChIInChI=1S/C13H22N4/c1-2-7-17-8-5-11(6-9-17)16-12-3-4-13(14)15-10-12/h3-4,10-11,16H,2,5-9H2,1H3,(H2,14,15)
InChIKeyMFVQCSZQTBGOGZ-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.95
Rot. Bonds4

About 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine

5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine (PubChem CID 54963421) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine
PubChem CID54963421
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine
SMILESCCCN1CCC(Nc2ccc(N)nc2)CC1
InChIInChI=1S/C13H22N4/c1-2-7-17-8-5-11(6-9-17)16-12-3-4-13(14)15-10-12/h3-4,10-11,16H,2,5-9H2,1H3,(H2,14,15)
InChIKeyMFVQCSZQTBGOGZ-UHFFFAOYSA-N
XLogP1.95
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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-[1-(cyclopropylmethyl)azepan-4-yl]pyridine-2,5-diamine;hydrochloride
CID 128995369
5-N-[(4S)-1-[(3-methyltriazol-4-yl)methyl]azepan-4-yl]pyridine-2,5-diamine
CID 129334899
N-(1-propylpiperidin-4-yl)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 43691551
5-N-[1-(pyridin-4-ylmethyl)azepan-4-yl]pyridine-2,5-diamine
CID 128992386
5-N-[(4S)-1-[(4-methyl-1,3-thiazol-2-yl)methyl]azepan-4-yl]pyridine-2,5-diamine
CID 129331643
5-fluoro-3-N-(1-propylpiperidin-4-yl)benzene-1,3-diamine
CID 54963571
5-N-[1-[(5-propan-2-yl-1,3-thiazol-2-yl)methyl]azepan-4-yl]pyridine-2,5-diamine;hydrochloride
CID 129001228
N-(3-ethoxyphenyl)-1-propylpiperidin-4-amine
CID 54864978
N-(1-propylazepan-4-yl)quinolin-3-amine
CID 65074656
5-N-[(4R)-1-[(2-cyclopropyl-1,3-thiazol-5-yl)methyl]azepan-4-yl]pyridine-2,5-diamine
CID 129343808
5-iodo-N-(1-propylpiperidin-4-yl)pyrimidin-2-amine
CID 113459447
1-propyl-N-thiophen-3-ylpiperidin-4-amine
CID 66352075

Frequently Asked Questions

What is the IUPAC name of 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine?
The IUPAC name of 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine (CID 54963421) is 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine.
What is the SMILES notation for 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine?
The canonical SMILES for 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine is CCCN1CCC(Nc2ccc(N)nc2)CC1.
What is the InChIKey of 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine?
The InChIKey is MFVQCSZQTBGOGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-2-7-17-8-5-11(6-9-17)16-12-3-4-13(14)15-10-12/h3-4,10-11,16H,2,5-9H2,1H3,(H2,14,15).
What are the key properties of 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine?
5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine has a molecular weight of 234.35 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(1-propylpiperidin-4-yl)pyridine-2,5-diamine is sourced from PubChem (CID 54963421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).