N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine

C14H18N2O — CID 83175594

IUPACN-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccco1)c1ccncc1
InChIInChI=1S/C14H18N2O/c1-2-7-16-14(11-13-4-3-10-17-13)12-5-8-15-9-6-12/h3-6,8-10,14,16H,2,7,11H2,1H3
InChIKeyZHCQXFLZZNUJLI-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.96
Rot. Bonds6

About N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine

N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine (PubChem CID 83175594) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine
PubChem CID83175594
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccco1)c1ccncc1
InChIInChI=1S/C14H18N2O/c1-2-7-16-14(11-13-4-3-10-17-13)12-5-8-15-9-6-12/h3-6,8-10,14,16H,2,7,11H2,1H3
InChIKeyZHCQXFLZZNUJLI-UHFFFAOYSA-N
XLogP2.96
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(furan-2-yl)-1-pyridin-4-ylethanamine
CID 83175492
N-[1-(4-bromophenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 83176193
N-[2-(furan-2-yl)-1-[4-(trifluoromethyl)phenyl]ethyl]propan-1-amine
CID 105029239
N-[1-(4-ethylsulfanylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 106849283
4-[2-(furan-2-yl)-1-(propylamino)ethyl]-N,N-dimethylaniline
CID 105177373
N-[2-(furan-2-yl)-1-(3-methyl-4-pyridinyl)ethyl]propan-1-amine
CID 83182976
N-[2-(furan-2-yl)-1-(3-methylphenyl)ethyl]propan-1-amine
CID 83176005
N-[2-(furan-2-yl)-1-(3-methoxyphenyl)ethyl]propan-1-amine
CID 83174801
N-[2-(furan-2-yl)-1-(5-methylthiophen-2-yl)ethyl]propan-1-amine
CID 105029308
N-[1-(4-fluoro-3-methylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 83175003
N-(2-pyridin-3-yl-1-pyridin-4-ylethyl)propan-1-amine
CID 104736220
N-[1-(5-ethylfuran-2-yl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 105029341

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine?
The IUPAC name of N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine (CID 83175594) is N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine.
What is the SMILES notation for N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine?
The canonical SMILES for N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine is CCCNC(Cc1ccco1)c1ccncc1.
What is the InChIKey of N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine?
The InChIKey is ZHCQXFLZZNUJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-2-7-16-14(11-13-4-3-10-17-13)12-5-8-15-9-6-12/h3-6,8-10,14,16H,2,7,11H2,1H3.
What are the key properties of N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine?
N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine has a molecular weight of 230.31 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-1-pyridin-4-ylethyl]propan-1-amine is sourced from PubChem (CID 83175594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).