N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine

C17H27N3 — CID 60689918

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine
SMILESCC(C)CCCCCCNCc1cn2ccccc2n1
InChIInChI=1S/C17H27N3/c1-15(2)9-5-3-4-7-11-18-13-16-14-20-12-8-6-10-17(20)19-16/h6,8,10,12,14-15,18H,3-5,7,9,11,13H2,1-2H3
InChIKeyRBLRHIVAPOQIBT-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.03
Rot. Bonds9

About N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine (PubChem CID 60689918) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine
PubChem CID60689918
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine
SMILESCC(C)CCCCCCNCc1cn2ccccc2n1
InChIInChI=1S/C17H27N3/c1-15(2)9-5-3-4-7-11-18-13-16-14-20-12-8-6-10-17(20)19-16/h6,8,10,12,14-15,18H,3-5,7,9,11,13H2,1-2H3
InChIKeyRBLRHIVAPOQIBT-UHFFFAOYSA-N
XLogP4.03
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-iodopentan-1-amine
CID 107320212
4-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)butan-1-amine
CID 106844928
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
CID 114505443
3-cyclopropyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
CID 115654278
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-(2-methoxyethoxy)propan-1-amine
CID 60698046
3-(imidazo[1,2-a]pyridin-2-ylmethylamino)-N-propan-2-ylpropanamide
CID 112688880
4-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylbutan-1-amine
CID 66089459
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-methylsulfanylpropan-1-amine
CID 63964732
2-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)hexan-1-amine
CID 60683059
3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
CID 115573483
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2,2-dimethoxyethanamine
CID 60687022
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpentan-3-amine
CID 61469725

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine (CID 60689918) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine is CC(C)CCCCCCNCc1cn2ccccc2n1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine?
The InChIKey is RBLRHIVAPOQIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-15(2)9-5-3-4-7-11-18-13-16-14-20-12-8-6-10-17(20)19-16/h6,8,10,12,14-15,18H,3-5,7,9,11,13H2,1-2H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 4.03, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine is sourced from PubChem (CID 60689918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).