2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine

C24H27F2N5 — CID 177146005

IUPAC2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine
SMILESFc1cc2ncccc2cc1CNC1CCCCC1F.NCc1cccn2ccnc12
InChIInChI=1S/C16H18F2N2.C8H9N3/c17-13-5-1-2-6-15(13)20-10-12-8-11-4-3-7-19-16(11)9-14(12)18;9-6-7-2-1-4-11-5-3-10-8(7)11/h3-4,7-9,13,15,20H,1-2,5-6,10H2;1-5H,6,9H2
InChIKeyBDWSSUFHTQXICB-UHFFFAOYSA-N
MW423.51 g/mol
LogP4.54
Rot. Bonds4

About 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine

2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine (PubChem CID 177146005) has the molecular formula C24H27F2N5 and a molecular weight of 423.51 g/mol. Its IUPAC name is 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine.

Molecular Properties

Compound Name2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine
PubChem CID177146005
Molecular FormulaC24H27F2N5
Molecular Weight423.51 g/mol
Exact Mass423.22
IUPAC Name2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine
SMILESFc1cc2ncccc2cc1CNC1CCCCC1F.NCc1cccn2ccnc12
InChIInChI=1S/C16H18F2N2.C8H9N3/c17-13-5-1-2-6-15(13)20-10-12-8-11-4-3-7-19-16(11)9-14(12)18;9-6-7-2-1-4-11-5-3-10-8(7)11/h3-4,7-9,13,15,20H,1-2,5-6,10H2;1-5H,6,9H2
InChIKeyBDWSSUFHTQXICB-UHFFFAOYSA-N
XLogP4.54
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.51
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine with MolForge

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Launch Full Analysis

Related Compounds

3-fluoro-2-[(7-fluoroquinolin-6-yl)methylamino]cyclohexan-1-ol
CID 177146065
imidazo[1,2-a]pyridin-8-ylmethanamine
CID 18766910
N-(imidazo[1,2-a]pyridin-8-ylmethyl)cyclobutanamine
CID 70874720
2-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)cyclopentan-1-amine
CID 126857804
ethane;6-ethyl-7-fluoroquinoline
CID 142320503
3-(3-chloro-4-fluorophenoxy)-N-(imidazo[1,2-a]pyridin-8-ylmethyl)cyclobutan-1-amine
CID 66562977
2-methyl-N-(quinolin-6-ylmethyl)cyclohexan-1-amine
CID 43183350
(2-cyclobutylimidazo[1,2-a]pyridin-8-yl)methanamine
CID 117137734
N-ethyl-2-quinolin-7-ylcycloheptan-1-amine
CID 81224624
N-[(7-fluoroquinolin-6-yl)methyl]-3-hydrazinyl-6-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 155149959
trans-(1R,2R)-1-N,2-N-bis(pyridin-2-ylmethyl)cyclohexane-1,2-diamine
CID 25052289
1-[(2-fluorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620975

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine?
The IUPAC name of 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine (CID 177146005) is 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine.
What is the SMILES notation for 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine?
The canonical SMILES for 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine is Fc1cc2ncccc2cc1CNC1CCCCC1F.NCc1cccn2ccnc12.
What is the InChIKey of 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine?
The InChIKey is BDWSSUFHTQXICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F2N2.C8H9N3/c17-13-5-1-2-6-15(13)20-10-12-8-11-4-3-7-19-16(11)9-14(12)18;9-6-7-2-1-4-11-5-3-10-8(7)11/h3-4,7-9,13,15,20H,1-2,5-6,10H2;1-5H,6,9H2.
What are the key properties of 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine?
2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine has a molecular weight of 423.51 g/mol, XLogP of 4.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(7-fluoroquinolin-6-yl)methyl]cyclohexan-1-amine;imidazo[1,2-a]pyridin-8-ylmethanamine is sourced from PubChem (CID 177146005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).