N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine

C11H13ClN2O — CID 106535724

IUPACN-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine
SMILESCC(CCl)N(C)c1nccc2occc12
InChIInChI=1S/C11H13ClN2O/c1-8(7-12)14(2)11-9-4-6-15-10(9)3-5-13-11/h3-6,8H,7H2,1-2H3
InChIKeyFBEKYIQYKOXCJZ-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.89
Rot. Bonds3

About N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine

N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine (PubChem CID 106535724) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine
PubChem CID106535724
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC NameN-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine
SMILESCC(CCl)N(C)c1nccc2occc12
InChIInChI=1S/C11H13ClN2O/c1-8(7-12)14(2)11-9-4-6-15-10(9)3-5-13-11/h3-6,8H,7H2,1-2H3
InChIKeyFBEKYIQYKOXCJZ-UHFFFAOYSA-N
XLogP2.89
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[furo[3,2-c]pyridin-4-yl(methyl)amino]propan-1-ol
CID 103873021
1-[furo[3,2-c]pyridin-4-yl(methyl)amino]propan-2-ol
CID 91662123
2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol
CID 106535445
N-ethyl-N'-furo[3,2-c]pyridin-4-yl-N'-methylethane-1,2-diamine
CID 106535603
N'-furo[3,2-c]pyridin-4-yl-N'-methyl-N-propylethane-1,2-diamine
CID 106535582
1-[furo[3,2-c]pyridin-4-yl(methyl)amino]-2-methylpropan-2-ol
CID 84594980
N-(4-chloro-3-methylbutan-2-yl)furo[3,2-c]pyridin-4-amine
CID 106535732
4-chlorofuro[3,2-c]pyridine;ethane
CID 144953720
2-[furo[3,2-c]pyridin-4-yl(propyl)amino]acetic acid
CID 106534820
ethyl 3-[furo[3,2-c]pyridin-4-yl(methyl)amino]propanoate
CID 103911820
N-[(2-aminophenyl)methyl]-N-propan-2-ylfuro[3,2-c]pyridin-4-amine
CID 106535415
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine
CID 71929736

Frequently Asked Questions

What is the IUPAC name of N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine?
The IUPAC name of N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine (CID 106535724) is N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine is CC(CCl)N(C)c1nccc2occc12.
What is the InChIKey of N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine?
The InChIKey is FBEKYIQYKOXCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-8(7-12)14(2)11-9-4-6-15-10(9)3-5-13-11/h3-6,8H,7H2,1-2H3.
What are the key properties of N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine?
N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine has a molecular weight of 224.69 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-chloropropan-2-yl)-N-methylfuro[3,2-c]pyridin-4-amine is sourced from PubChem (CID 106535724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).