1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide

C18H22FN3O2 — CID 113211055

IUPAC1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
SMILESO=C(NCCN1CCOCC1)C1(c2c[nH]c3cc(F)ccc23)CC1
InChIInChI=1S/C18H22FN3O2/c19-13-1-2-14-15(12-21-16(14)11-13)18(3-4-18)17(23)20-5-6-22-7-9-24-10-8-22/h1-2,11-12,21H,3-10H2,(H,20,23)
InChIKeyUCRTZHYKSSTTDH-UHFFFAOYSA-N
MW331.39 g/mol
LogP1.79
Rot. Bonds5

About 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide

1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide (PubChem CID 113211055) has the molecular formula C18H22FN3O2 and a molecular weight of 331.39 g/mol. Its IUPAC name is 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
PubChem CID113211055
Molecular FormulaC18H22FN3O2
Molecular Weight331.39 g/mol
Exact Mass331.17
IUPAC Name1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
SMILESO=C(NCCN1CCOCC1)C1(c2c[nH]c3cc(F)ccc23)CC1
InChIInChI=1S/C18H22FN3O2/c19-13-1-2-14-15(12-21-16(14)11-13)18(3-4-18)17(23)20-5-6-22-7-9-24-10-8-22/h1-2,11-12,21H,3-10H2,(H,20,23)
InChIKeyUCRTZHYKSSTTDH-UHFFFAOYSA-N
XLogP1.79
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.39
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-fluoro-1H-indol-3-yl)-N-(3-methylbutyl)cyclopropane-1-carboxamide
CID 113211115
1-(6-fluoro-1H-indol-3-yl)-N-(3-phenylpropyl)cyclopropane-1-carboxamide
CID 113211109
1-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 110408174
1-(6-fluoro-1H-indol-3-yl)-N-(4-fluorophenyl)cyclopropane-1-carboxamide
CID 113211144
1-(6-fluoro-1H-indol-3-yl)-N-[2-(4-methoxyphenoxy)ethyl]cyclopropane-1-carboxamide
CID 113211110
1-(6-fluoro-1H-indol-3-yl)-N-(3-fluorophenyl)cyclopropane-1-carboxamide
CID 113211186
1-(6-fluoro-1H-indol-3-yl)-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 113211076
4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide
CID 47717791
6-chloro-N-(2-morpholin-4-ylethyl)-1H-indole-3-carboxamide
CID 113206353
N-(2-chlorophenyl)-1-(6-fluoro-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113211145
3-(4-fluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016608
1-(6-fluoro-1H-indol-3-yl)-N-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 113211157

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide (CID 113211055) is 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide is O=C(NCCN1CCOCC1)C1(c2c[nH]c3cc(F)ccc23)CC1.
What is the InChIKey of 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide?
The InChIKey is UCRTZHYKSSTTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN3O2/c19-13-1-2-14-15(12-21-16(14)11-13)18(3-4-18)17(23)20-5-6-22-7-9-24-10-8-22/h1-2,11-12,21H,3-10H2,(H,20,23).
What are the key properties of 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide?
1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide has a molecular weight of 331.39 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 113211055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).