N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine

C13H20N4 — CID 106155268

IUPACN'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine
SMILESCC(CN)CCCNc1cccc2nccn12
InChIInChI=1S/C13H20N4/c1-11(10-14)4-3-7-15-12-5-2-6-13-16-8-9-17(12)13/h2,5-6,8-9,11,15H,3-4,7,10,14H2,1H3
InChIKeyHPBFUGPKFZBJDN-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.12
Rot. Bonds6

About N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine

N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine (PubChem CID 106155268) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine.

Molecular Properties

Compound NameN'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine
PubChem CID106155268
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine
SMILESCC(CN)CCCNc1cccc2nccn12
InChIInChI=1S/C13H20N4/c1-11(10-14)4-3-7-15-12-5-2-6-13-16-8-9-17(12)13/h2,5-6,8-9,11,15H,3-4,7,10,14H2,1H3
InChIKeyHPBFUGPKFZBJDN-UHFFFAOYSA-N
XLogP2.12
TPSA55.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine?
The IUPAC name of N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine (CID 106155268) is N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine.
What is the SMILES notation for N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine?
The canonical SMILES for N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine is CC(CN)CCCNc1cccc2nccn12.
What is the InChIKey of N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine?
The InChIKey is HPBFUGPKFZBJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-11(10-14)4-3-7-15-12-5-2-6-13-16-8-9-17(12)13/h2,5-6,8-9,11,15H,3-4,7,10,14H2,1H3.
What are the key properties of N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine?
N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine has a molecular weight of 232.33 g/mol, XLogP of 2.12, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine is sourced from PubChem (CID 106155268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).