3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine

C14H17FN2 — CID 115038926

IUPAC3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine
SMILESNCCCc1cc2cc(F)ccc2n1C1CC1
InChIInChI=1S/C14H17FN2/c15-11-3-6-14-10(8-11)9-13(2-1-7-16)17(14)12-4-5-12/h3,6,8-9,12H,1-2,4-5,7,16H2
InChIKeyMEWCMRNSYKFARF-UHFFFAOYSA-N
MW232.30 g/mol
LogP3.01
Rot. Bonds4

About 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine

3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine (PubChem CID 115038926) has the molecular formula C14H17FN2 and a molecular weight of 232.30 g/mol. Its IUPAC name is 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine.

Molecular Properties

Compound Name3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine
PubChem CID115038926
Molecular FormulaC14H17FN2
Molecular Weight232.30 g/mol
Exact Mass232.14
IUPAC Name3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine
SMILESNCCCc1cc2cc(F)ccc2n1C1CC1
InChIInChI=1S/C14H17FN2/c15-11-3-6-14-10(8-11)9-13(2-1-7-16)17(14)12-4-5-12/h3,6,8-9,12H,1-2,4-5,7,16H2
InChIKeyMEWCMRNSYKFARF-UHFFFAOYSA-N
XLogP3.01
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-fluoro-1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]indol-2-yl]methanamine
CID 134578491
6-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)hexan-1-amine
CID 62378467
2-(1-cyclopentylindol-2-yl)ethanamine
CID 115115551
3-(4-bromo-1-cyclopropylindol-2-yl)propan-1-amine
CID 115053082
2-(5-fluoro-1-methylindol-2-yl)ethanamine
CID 55253436
3-(5-chloro-1-cyclopropylbenzimidazol-2-yl)propan-1-amine
CID 60785360
[5-fluoro-1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]indol-2-yl]methylcarbamic acid
CID 134563625
1-cyclopropyl-2-ethylindole-5-carboxamide
CID 145369091
5-fluoro-1-(4-propylcyclohexyl)benzimidazol-2-amine
CID 63546950
5-fluoro-1-methyl-2-[3-(4-methylpiperazin-1-yl)propyl]indole
CID 170864165
2-[4-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)-1,3-thiazol-2-yl]ethanamine
CID 66380200
6-(5-chloro-1-cyclopropylbenzimidazol-2-yl)hexan-1-amine
CID 60783944

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine?
The IUPAC name of 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine (CID 115038926) is 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine.
What is the SMILES notation for 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine?
The canonical SMILES for 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine is NCCCc1cc2cc(F)ccc2n1C1CC1.
What is the InChIKey of 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine?
The InChIKey is MEWCMRNSYKFARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2/c15-11-3-6-14-10(8-11)9-13(2-1-7-16)17(14)12-4-5-12/h3,6,8-9,12H,1-2,4-5,7,16H2.
What are the key properties of 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine?
3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine has a molecular weight of 232.30 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropyl-5-fluoroindol-2-yl)propan-1-amine is sourced from PubChem (CID 115038926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).