N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine

C16H24N4O — CID 103535779

IUPACN-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
SMILESCCCNCc1c(N2CCC(OC)C2)nc2ccccn12
InChIInChI=1S/C16H24N4O/c1-3-8-17-11-14-16(19-10-7-13(12-19)21-2)18-15-6-4-5-9-20(14)15/h4-6,9,13,17H,3,7-8,10-12H2,1-2H3
InChIKeyLDUYDFWLUAEYTG-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.06
Rot. Bonds6

About N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine

N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine (PubChem CID 103535779) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
PubChem CID103535779
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC NameN-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
SMILESCCCNCc1c(N2CCC(OC)C2)nc2ccccn12
InChIInChI=1S/C16H24N4O/c1-3-8-17-11-14-16(19-10-7-13(12-19)21-2)18-15-6-4-5-9-20(14)15/h4-6,9,13,17H,3,7-8,10-12H2,1-2H3
InChIKeyLDUYDFWLUAEYTG-UHFFFAOYSA-N
XLogP2.06
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]cyclopropanamine
CID 103535879
1-[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine
CID 103540574
2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 103534998
3-(bromomethyl)-2-(4-methoxypiperidin-1-yl)imidazo[1,2-a]pyridine
CID 107080186
1-[2-(3-methoxy-4-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 102961210
2-methoxy-N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]ethanamine
CID 63059993
N,N-dimethyl-1-[3-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]pyrrolidin-3-amine
CID 63164894
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 103499447
N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
CID 115591883
3-(bromomethyl)-2-(4-ethoxypiperidin-1-yl)imidazo[1,2-a]pyridine
CID 107080810
N-[[2-(2-methylimidazol-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
CID 43478576
N-[[2-(3-methoxypiperidin-1-yl)phenyl]methyl]propan-1-amine
CID 102961556

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine?
The IUPAC name of N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine (CID 103535779) is N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine is CCCNCc1c(N2CCC(OC)C2)nc2ccccn12.
What is the InChIKey of N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine?
The InChIKey is LDUYDFWLUAEYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-3-8-17-11-14-16(19-10-7-13(12-19)21-2)18-15-6-4-5-9-20(14)15/h4-6,9,13,17H,3,7-8,10-12H2,1-2H3.
What are the key properties of N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine?
N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine has a molecular weight of 288.40 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine is sourced from PubChem (CID 103535779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).