(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide

C17H24FN3O — CID 31688904

IUPAC(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
SMILESC[C@H](C(=O)NC1CC1)N1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C17H24FN3O/c1-13(17(22)19-15-6-7-15)21-10-8-20(9-11-21)12-14-4-2-3-5-16(14)18/h2-5,13,15H,6-12H2,1H3,(H,19,22)/t13-/m1/s1
InChIKeySSFBZMWZZCYFBW-CYBMUJFWSA-N
MW305.40 g/mol
LogP1.61
Rot. Bonds5

About (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide

(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide (PubChem CID 31688904) has the molecular formula C17H24FN3O and a molecular weight of 305.40 g/mol. Its IUPAC name is (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
PubChem CID31688904
Molecular FormulaC17H24FN3O
Molecular Weight305.40 g/mol
Exact Mass305.19
IUPAC Name(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
SMILESC[C@H](C(=O)NC1CC1)N1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C17H24FN3O/c1-13(17(22)19-15-6-7-15)21-10-8-20(9-11-21)12-14-4-2-3-5-16(14)18/h2-5,13,15H,6-12H2,1H3,(H,19,22)/t13-/m1/s1
InChIKeySSFBZMWZZCYFBW-CYBMUJFWSA-N
XLogP1.61
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-phenylpropanamide
CID 46802310
2-[4-[(2-bromophenyl)methyl]piperazin-1-yl]-N-cyclopropylpropanamide
CID 46514218
(2S)-N-cyclopropyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide
CID 9047076
(2S)-N-cyclopropyl-2-[4-[(7-fluoro-1-benzothiophen-3-yl)methyl]piperazin-1-yl]propanamide
CID 95975224
(2R)-N-carbamoyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
CID 32721522
N-cyclopropyl-2-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]propanamide
CID 43043050
(2S)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 30720422
(2R)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-N-(2-methoxyphenyl)propanamide
CID 30642247
(2S)-2-(4-benzylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 2410459
(2R)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]-2-methylsulfonylpropanamide
CID 94797005
(2S)-2-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 30736259
(2S)-2-(4-benzylpiperazin-1-yl)-N-cyclohexylpropanamide
CID 51613241

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide?
The IUPAC name of (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide (CID 31688904) is (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide?
The canonical SMILES for (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide is C[C@H](C(=O)NC1CC1)N1CCN(Cc2ccccc2F)CC1.
What is the InChIKey of (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide?
The InChIKey is SSFBZMWZZCYFBW-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H24FN3O/c1-13(17(22)19-15-6-7-15)21-10-8-20(9-11-21)12-14-4-2-3-5-16(14)18/h2-5,13,15H,6-12H2,1H3,(H,19,22)/t13-/m1/s1.
What are the key properties of (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide?
(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide has a molecular weight of 305.40 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide is sourced from PubChem (CID 31688904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).