N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine

C13H15N5 — CID 102625840

IUPACN-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine
SMILESc1cc(NCCCc2ncc[nH]2)n2ccnc2c1
InChIInChI=1S/C13H15N5/c1-4-12(18-10-9-17-13(18)5-1)16-6-2-3-11-14-7-8-15-11/h1,4-5,7-10,16H,2-3,6H2,(H,14,15)
InChIKeyGDXWJLFNDQFZSD-UHFFFAOYSA-N
MW241.30 g/mol
LogP2.10
Rot. Bonds5

About N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine

N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine (PubChem CID 102625840) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine.

Molecular Properties

Compound NameN-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine
PubChem CID102625840
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC NameN-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine
SMILESc1cc(NCCCc2ncc[nH]2)n2ccnc2c1
InChIInChI=1S/C13H15N5/c1-4-12(18-10-9-17-13(18)5-1)16-6-2-3-11-14-7-8-15-11/h1,4-5,7-10,16H,2-3,6H2,(H,14,15)
InChIKeyGDXWJLFNDQFZSD-UHFFFAOYSA-N
XLogP2.10
TPSA58.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 52.10
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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Related Compounds

N-butylimidazo[1,2-a]pyridin-5-amine
CID 102625326
N-[(E)-pent-3-enyl]imidazo[1,2-a]pyridin-5-amine
CID 102625793
N-[3-(1H-imidazol-2-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 90871760
N-(5-methylhexyl)imidazo[1,2-a]pyridin-5-amine
CID 102625728
N'-ethyl-N-imidazo[1,2-a]pyridin-5-yl-N'-methylethane-1,2-diamine
CID 102625580
N'-imidazo[1,2-a]pyridin-5-yl-2-methylpentane-1,5-diamine
CID 106155268
N-[3-(1H-imidazol-2-yl)propyl]-2-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 141191562
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazo[1,2-a]pyridin-5-amine
CID 102625611
N-[1-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine
CID 102625839
2-(imidazo[1,2-a]pyridin-5-ylamino)acetic acid
CID 162696041
N-[3-(1H-imidazol-2-yl)propyl]-6-phenylpyridin-2-amine
CID 91802782
N-[[4-(2-aminoethyl)phenyl]methyl]imidazo[1,2-a]pyridin-5-amine
CID 102626037

Frequently Asked Questions

What is the IUPAC name of N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine?
The IUPAC name of N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine (CID 102625840) is N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine.
What is the SMILES notation for N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine?
The canonical SMILES for N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine is c1cc(NCCCc2ncc[nH]2)n2ccnc2c1.
What is the InChIKey of N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine?
The InChIKey is GDXWJLFNDQFZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-4-12(18-10-9-17-13(18)5-1)16-6-2-3-11-14-7-8-15-11/h1,4-5,7-10,16H,2-3,6H2,(H,14,15).
What are the key properties of N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine?
N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine has a molecular weight of 241.30 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1H-imidazol-2-yl)propyl]imidazo[1,2-a]pyridin-5-amine is sourced from PubChem (CID 102625840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).