N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine

C10H15FN2 — CID 104738943

IUPACN-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine
SMILESCC(C)NCCc1ccncc1F
InChIInChI=1S/C10H15FN2/c1-8(2)13-6-4-9-3-5-12-7-10(9)11/h3,5,7-8,13H,4,6H2,1-2H3
InChIKeyJBHGOJGNSGUWPN-UHFFFAOYSA-N
MW182.24 g/mol
LogP1.76
Rot. Bonds4

About N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine

N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine (PubChem CID 104738943) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine
PubChem CID104738943
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC NameN-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine
SMILESCC(C)NCCc1ccncc1F
InChIInChI=1S/C10H15FN2/c1-8(2)13-6-4-9-3-5-12-7-10(9)11/h3,5,7-8,13H,4,6H2,1-2H3
InChIKeyJBHGOJGNSGUWPN-UHFFFAOYSA-N
XLogP1.76
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-fluoro-4-pyridinyl)-N-propan-2-ylbutan-1-amine
CID 104739416
1-(3-fluoro-4-pyridinyl)-4-methylpentan-3-ol
CID 104739077
N-(2-pyridin-4-ylethyl)propan-2-amine;dihydrochloride
CID 91928341
N-(3-fluoro-4-pyridinyl)-2-(propan-2-ylamino)ethanesulfonamide
CID 107595222
N-[2-(5-chloro-2-fluorophenyl)ethyl]propan-2-amine
CID 82471422
N-[(3-fluoro-4-pyridinyl)methyl]-2-methylpropanamide
CID 171523645
4-(3-bromopropyl)-3-fluoropyridine
CID 104739099
3-fluoro-4-(fluoromethyl)pyridine
CID 105427398
N-[2-(3-methylimidazo[4,5-c]pyridin-2-yl)ethyl]propan-2-amine
CID 114793422
N-[2-(5-bromo-2-fluorophenyl)ethyl]propan-2-amine
CID 62548311
N-[[3-(3-fluoro-4-pyridinyl)furan-2-yl]methyl]propan-2-amine
CID 106887993
N-[[2-fluoro-4-(3-fluoro-4-pyridinyl)phenyl]methyl]propan-2-amine
CID 104738829

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine (CID 104738943) is N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine is CC(C)NCCc1ccncc1F.
What is the InChIKey of N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine?
The InChIKey is JBHGOJGNSGUWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-8(2)13-6-4-9-3-5-12-7-10(9)11/h3,5,7-8,13H,4,6H2,1-2H3.
What are the key properties of N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine?
N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine has a molecular weight of 182.24 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluoro-4-pyridinyl)ethyl]propan-2-amine is sourced from PubChem (CID 104738943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).