1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine

C14H13FN2 — CID 129257642

IUPAC1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine
SMILESNC1(c2cnccc2-c2ccccc2F)CC1
InChIInChI=1S/C14H13FN2/c15-13-4-2-1-3-11(13)10-5-8-17-9-12(10)14(16)6-7-14/h1-5,8-9H,6-7,16H2
InChIKeyJJFDMBHRZGVTIO-UHFFFAOYSA-N
MW228.27 g/mol
LogP2.84
Rot. Bonds2

About 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine

1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine (PubChem CID 129257642) has the molecular formula C14H13FN2 and a molecular weight of 228.27 g/mol. Its IUPAC name is 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine
PubChem CID129257642
Molecular FormulaC14H13FN2
Molecular Weight228.27 g/mol
Exact Mass228.11
IUPAC Name1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine
SMILESNC1(c2cnccc2-c2ccccc2F)CC1
InChIInChI=1S/C14H13FN2/c15-13-4-2-1-3-11(13)10-5-8-17-9-12(10)14(16)6-7-14/h1-5,8-9H,6-7,16H2
InChIKeyJJFDMBHRZGVTIO-UHFFFAOYSA-N
XLogP2.84
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(2-methylphenyl)-3-pyridinyl]cyclopropan-1-amine
CID 129257632
1-(3-phenyl-4-pyridinyl)cyclopropan-1-amine
CID 115008883
3-[1-[(2,5-dichlorophenyl)methoxy]cyclopropyl]-4-(2-fluorophenyl)pyridine
CID 129241725
1-[4-(trifluoromethyl)-3-pyridinyl]cyclopropan-1-amine
CID 112706938
1-(4-ethenyl-3-pyridinyl)cyclopropan-1-amine
CID 74891778
3-(2-fluorophenyl)-4-methylpyridine
CID 46313062
1-[5-(2-fluorophenyl)-2-pyridinyl]cyclopropan-1-amine
CID 141105175
3-(2-fluorophenyl)-1,6-naphthyridin-2-amine
CID 171354245
5-(2-fluorophenyl)-7H-pyrido[4,3-c]azepin-9-amine
CID 167492772
3-(2-fluorophenyl)pyridine-4-carboxylic acid
CID 46313119
4-(2,3-difluorophenyl)-3-fluoropyridine
CID 118801718
1-(3-chloro-4-pyridinyl)cyclopropan-1-amine
CID 55297970

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine?
The IUPAC name of 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine (CID 129257642) is 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine?
The canonical SMILES for 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine is NC1(c2cnccc2-c2ccccc2F)CC1.
What is the InChIKey of 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine?
The InChIKey is JJFDMBHRZGVTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2/c15-13-4-2-1-3-11(13)10-5-8-17-9-12(10)14(16)6-7-14/h1-5,8-9H,6-7,16H2.
What are the key properties of 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine?
1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine has a molecular weight of 228.27 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-fluorophenyl)-3-pyridinyl]cyclopropan-1-amine is sourced from PubChem (CID 129257642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).